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  • 1.
    Dalibon, Eugenia. L.
    et al.
    UTN, Argentina.
    Czerwiec, Thierry
    Univ Lorraine, France.
    Trava-Airoldi, Vladimir J.
    INPE, Brazil.
    Ghafoor, Naureen
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten.
    Rogström, Lina
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Bruhl, Sonia P.
    UTN, Argentina.
    Characterization of DLC coatings over nitrided stainless steel with and without nitriding pre-treatment using annealing cycles2019Inngår i: JOURNAL OF MATERIALS RESEARCH AND TECHNOLOGY-JMRandT, ISSN 2238-7854, Vol. 8, nr 2, s. 1653-1662Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    Amorphous hydrogenated diamond-like carbon (DLC) coatings were deposited using plasma assisted chemical vapour deposition (PACVD) on precipitation hardening (PH) stainless steel.Plasma nitriding has been used as pre-treatment to enhance adhesion and mechanical properties. Chemical and mechanical properties of DLC coatings are dependent on the hydrogen content and so on the relation between sp(3)/sp(2) bondings. The bondings and the structure of the DLC film change with temperature. In this work, a study of the thermal degradation and the evolution of the mechanical properties of DLC coatings over PH stainless steel have been carried out, including the effect of an additional nitrided layer. Nitrided and non-nitrided steel samples were subjected to the same coated in the same conditions, and they were submitted to the same thermal cycles, heating from room temperature to 600 degrees C in several steps. After each cycle, Raman spectra and surface topography measurements were performed and analyzed. Nanohardness measurements and tribological tests, using a pin-on-disc machine, were carried out to analyze variations in the friction coefficient and the wear resistance. The duplex sample, with nitriding as pre-treatment showed a better thermal stability. For duplex sample, the coating properties, such as adhesion, and friction coefficient were sustained after annealing at higher temperatures; whereas it was not the case for only coated sample. (C) 2018 Brazilian Metallurgical, Materials and Mining Association. Published by Elsevier Editora Ltda.

  • 2.
    Rogström, Lina
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Johansson, Mats P.
    Seco Tools AB, Sweden.
    Pilemalm, Robert
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten.
    Ghafoor, Naureen
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten.
    Johnson, L. J. S.
    Sandvik Coromant, Sweden.
    Schell, N.
    Helmholtz Zentrum Geesthacht, Germany.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Decomposition routes and strain evolution in arc deposited TiZrAlN coatings2019Inngår i: Journal of Alloys and Compounds, ISSN 0925-8388, E-ISSN 1873-4669, Vol. 779, s. 261-269Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    Phase, microstructure, and strain evolution during annealing of arc deposited TiZrAlN coatings are studied using in situ x-ray scattering and ex situ transmission electron microscopy. We find that the decomposition route changes from nucleation and growth of wurtzite AlN to spinodal decomposition when the Zr-content is decreased and the Al-content increases. Decomposition of Ti0.31Zr0.24Al0.45N results in homogeneously distributed wurtzite AlN grains in a cubic, dislocation-dense matrix of TiZrN consisting of domains of different chemical composition. The combination of high dislocation density, variation of chemical composition within the cubic grains, and evenly distributed wurtzite AlN grains results in high compressive strains, -1.1%, which are retained after 3 h at 1100 degrees C. In coatings with higher Zr-content, the strains relax during annealing above 900 degrees C due to grain growth and defect annihilation. (C) 2018 Elsevier B.V. All rights reserved.

    Fulltekst tilgjengelig fra 2020-11-14 12:11
  • 3.
    Calamba, Katherine
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. Univ Lorraine, France.
    Pierson, J. F.
    Univ Lorraine, France.
    Bruyere, S.
    Univ Lorraine, France.
    Le Febvrier, Arnaud
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten.
    Eklund, Per
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten.
    Barrirero, Jenifer
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. Saarland Univ, Germany.
    Muecklich, F.
    Saarland Univ, Germany.
    Boyd, Robert
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Plasma och beläggningsfysik. Linköpings universitet, Tekniska fakulteten.
    Jöesaar Johansson, Mats
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. SECO Tools AB, Sweden.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Dislocation structure and microstrain evolution during spinodal decomposition of reactive magnetron sputtered heteroepixatial c-(Ti-0.37,Al-0.63)N/c-TiN films grown on MgO(001) and (111) substrates2019Inngår i: Journal of Applied Physics, ISSN 0021-8979, E-ISSN 1089-7550, Vol. 125, nr 10, artikkel-id 105301Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    Heteroepitaxial c-(Ti-0.37,Al-0.63)N thin films were grown on MgO(001) and MgO(111) substrates using reactive magnetron sputtering. High resolution high-angle annular dark-field scanning transmission electron micrographs show coherency between the film and the substrate. In the as-deposited state, x-ray diffraction reciprocal space maps show a strained epitaxial film. Corresponding geometric phase analysis (GPA) deformation maps show a high stress in the film. At elevated temperature (900 degrees C), the films decompose to form iso-structural coherent c-Al- and c-TiN-rich domains, elongated along the elastically soft amp;lt;100amp;gt; directions. GPA analysis reveals that the c-TiN domains accommodate more dislocations than the c-AlN domains. This is because of the stronger directionality of the covalent bonds in c-AlN compared with c-TiN, making it more favorable for the dislocations to accumulate in c-TiN. The defect structure and strain generation in c-(Ti,Al)N during spinodal decomposition is affected by the chemical bonding state and elastic properties of the segregated domains.

  • 4.
    Syed, Bilal
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. Linköping University.
    Jöessar, Mats J.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. SECO Tools AB, Fagersta, Sweden.
    Polcik, Peter
    PLANSEE Composite Materials GmbH, Lechbruck am See, Germany.
    Kolozsvari, Szilard
    PLANSEE Composite Materials GmbH, Lechbruck am See, Germany.
    Håkansson, Greger
    Ionbond Sweden AB, Box 1161, Linköping, Sweden.
    Johnson, Lars
    Sandvik Coromant, Stockholm, Sweden.
    Ahlgren, Mats
    Sandvik Coromant, Stockholm, Sweden.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Effect of work function and cohesive energy of the constituent phases of Ti-50 at.% Al cathode during arc deposition of Ti-Al-N coatings2019Inngår i: Surface & Coatings Technology, ISSN 0257-8972, E-ISSN 1879-3347, Vol. 357, s. 393-401Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    The differences in work function (W.F.) and cohesive energy (C.E.) of the phases constituting the cathode, plays an important role in the formation of the converted layer at its near-surface region during cathodic arc deposition. As a consequence, this also affects the deposition conditions for the coatings. In this study, we explore the effect of W.F. and C.E. of the constituent phases during arc evaporation by utilizing two kinds of customized Ti-50 at.% Al cathodes with different phase compositions. Our results show that during reactive arc evaporation the disparity in W.F. and C.E. among the constituent phases of Ti-50 at.% Al cathodes leads to preferential erosion of the phases with lower W.F. and C.E. The aforementioned preferential erosion begets higher surface roughness on the Ti-50 at.% Al cathode with a wider range of W.F. and C.E. disparity. It is also observed that the thermal conductivity of the Ti-50 at.% Al cathode plays a dominant role in the deposition rate of Ti-Al-N coating. This article also presents how the surface geometry of the cathode in the presence of arc guiding magnetic field significantly influences the microstructure of the deposited coatings.

    Fulltekst tilgjengelig fra 2020-10-15 12:50
  • 5.
    Barrirero, Jenifer
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. Saarland Univ, Germany.
    Pauly, C.
    Saarland Univ, Germany.
    Engstler, M.
    Saarland Univ, Germany.
    Ghanbaja, J.
    Univ Lorraine, France.
    Ghafoor, Naureen
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten.
    Li, J.
    Univ Leoben, Austria.
    Schumacher, P.
    Univ Leoben, Austria.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Muecklich, F.
    Saarland Univ, Germany.
    Eutectic modification by ternary compound cluster formation in Al-Si alloys2019Inngår i: Scientific Reports, ISSN 2045-2322, E-ISSN 2045-2322, Vol. 9, artikkel-id 5506Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    Al-alloys with Si as the main alloying element constitute the vast majority of Al castings used commercially today. The eutectic Si microstructure in these alloys can be modified from plate-like to coral-like by the addition of a small amount of a third element to improve ductility and toughness. In this investigation the effects of Eu and Yb are studied and their influence on the microstructure is compared to further understand this modification. The two elements impact the alloy differently, where Eu modifies Si into a coral-like structure while Yb does not. Atom probe tomography shows that Eu is present within the Si phase in the form of ternary compound Al2Si2Eu clusters, while Yb is absent in the Si phase. This indicates that the presence of ternary compound clusters within Si is a necessary condition for the formation of a coral-like structure. A crystallographic orientation relationship between Si and the Al2Si2Eu phase was found, where the following plane normals are parallel: 011(Si) //0001(Al2Si2Eu), 111(Si)//6 (7) over bar 10(Al2Si2Eu) and 011(Si)//6 (7) over bar 10(Al2Si2Eu). No crystallographic relationship was found between Si and Al2Si2Yb. The heterogeneous formation of coherent Al2Si2Eu clusters inside the Si-phase is suggested to trigger the modification of the microstructure.

  • 6.
    Wu, Pei-Hsuan
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Mäkie, Peter
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Björk, Emma
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. Univ Ulm, Germany.
    Growth and Functionalization of Particle-Based Mesoporous Silica Films and Their Usage in Catalysis2019Inngår i: NANOMATERIALS, ISSN 2079-4991, Vol. 9, nr 4, artikkel-id 562Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    We report the formation of mesoporous films consisting of SBA-15 particles grown directly onto substrates and their usage as catalysts in esterification of acetic acid and ethanol. The film thickness was altered between 80 nm and 750 nm by adding NH4F to the synthesis solution. The salt also affects the formation rate of the particles, and substrates must be added during the formation of the siliceous network in the solution. Various substrate functionalizations were tested and hydrophobic substrates are required for a successful film growth. We show that large surfaces (amp;gt; 75 cm(2)), as well as 3D substrates, can be homogenously coated. Further, the films were functionalized, either with acetic acid through co-condensation, or by coating the films with a thin carbon layer through exposure to furfuryl alcohol fumes followed by carbonization and sulfonation with H2SO4. The carbon-coated film was shown to be an efficient catalyst in the esterification reaction with acetic acid and ethanol. Due to the short, accessible mesopores, chemical variability, and possibility to homogenously cover large, rough surfaces. the films have a large potential for usage in various applications such as catalysis, sensing, and drug delivery.

  • 7.
    Calamba, Katherine
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. Univ Lorraine, France.
    Barrirero, Jenifer
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. Saarland Univ, Germany.
    Joesaar, M. P. Johansson
    SECO Tools AB, Sweden.
    Bruyere, S.
    Univ Lorraine, France.
    Boyd, Robert
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Plasma och beläggningsfysik. Linköpings universitet, Tekniska fakulteten.
    Pierson, J. F.
    Univ Lorraine, France.
    Le Febvrier, Arnaud
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten.
    Muecklich, F.
    Saarland Univ, Germany.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Growth and high temperature decomposition of epitaxial metastable wurtzite (Ti1-x,Al-x)N(0001) thin films2019Inngår i: Thin Solid Films, ISSN 0040-6090, E-ISSN 1879-2731, Vol. 688, artikkel-id 137414Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    The structure, growth, and phase stability of (Ti1-x,Al-x)N films with high Al content were investigated. (Ti1-x,Al-x)N (x= 0.63 and 0.77) thin films were grown on MgO (111) substrates at 700 degrees C using a UHV DC magnetron sputtering system. The (Ti-0.37,Al-0.63)N film is a single crystal with a cubic NaCl (B1) structure while the (T-i0.23,Al-0.77)N film only shows epitaxial growth of the same cubic phase in the first few atomic layers. With increasing film thickness, epitaxial wurtzite (B4) forms. The thin cubic layer and the wurtzite film has an orientation relationship of c-(Ti-0.23,Al-0.77)N(111)[110]parallel to w-(Ti-0.23,Al-0.77)N(0001)[11 (2) over bar0]. Continued deposition results in a gradual break-down of the epitaxial growth. It is replaced by polycrystalline growth of wurtzite columns with a high degree of 0001 texture, separated by a Tienriched cubic phase. In the as-deposited state, c-(Ti-0.27,Al-0.63)N displays a homogeneous chemical distribution while the w-(Ti-0.23,Al-0.77)N has segregated to Al- and Ti-rich domains. Annealing at 900 degrees C resulted in the spinodal decomposition of the metastable c-(Ti-0.27,Al-0.63)N film and formation of coherent elongated c-AlN and cTi-N-rich domains with an average width of 4.5 +/- 0.2 nm while the width of the domains in the w-(Ti-0.23,Al-0.77)N film only marginally increases to 2.8 +/- 0.1 nm. The slower coarsening rate of the wurtzite structure compared to cubic is indicative of a higher thermal stability.

  • 8.
    Atakan, Aylin
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Keraudy, Julien
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Plasma och beläggningsfysik. Linköpings universitet, Tekniska fakulteten.
    Mäkie, Peter
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Hulteberg, Christian
    Lund Univ, Sweden.
    Björk, Emma
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Impact of the morphological and chemical properties of copper-zirconium-SBA-15 catalysts on the conversion and selectivity in carbon dioxide hydrogenation2019Inngår i: Journal of Colloid and Interface Science, ISSN 0021-9797, E-ISSN 1095-7103, Vol. 546, s. 163-173Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    A hybrid catalyst consisting of Zr-doped mesoporous silica (Zr-SBA-15) supports with intergrown Cu nanoparticles was used to study the effects of a catalysts chemical states on CO2 hydrogenation. The chemical state of the catalyst was altered by using tetraethyl orthosilicate (TEOS) or sodium metasilicate (SMS) as the silica precursor in the synthesis of the Zr-SBA-15 framework, and infiltration (Inf) or evaporation induced wetness impregnation (EIWI) as the Cu loading method. As a result, the silica precursor mainly affects the activity of the catalyst whereas the Cu loading method alters the selectivity of the products. TEOS materials exhibit a higher catalytic activity compared to SMS materials due to different Zr dispersion and bonding to the silica matrix. EIWI catalysts display selectivity for methanol formation, while the Inf ones enable methanol conversion to DME. This is correlated to a higher Zr content and lower Cu oxidation states of EIWI prepared catalysts. (C) 2019 Elsevier Inc. All rights reserved.

  • 9.
    Barrirero, J.
    et al.
    Saarland Univ, Germany.
    Engstler, M.
    Saarland Univ, Germany.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Muecklich, F.
    Saarland Univ, Germany.
    Phase Selective Sample Preparation of Al-Si alloys for Atom Probe Tomography2019Inngår i: Praktische metallographie, ISSN 0032-678X, E-ISSN 2195-8599, Vol. 56, nr 2, s. 76-90Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    We present how the conventional focused ion beam (FIB) lift-out method can be modified to obtain phase selective specimens for atom probe tomography (APT). The modified method combines selective deep etching with site-specific lift-out using a micromanipulator in a FIB/SEM workstation. This method is used for phase-selective sample preparation in alloys with complex microstructures such as the coral- and plate-like silicon structures in the eutectic phase of Al-Si castings. The method proves to be both, practical and robust, with a high success rate of high-quality phase-specific APT specimens.

  • 10.
    Broering Chaar, Ana Beatriz
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. Department of Materials Science and Engineering, D3.3 Saarland University, Saarbrücken, Germany.
    Syed, Muhammad Bilal
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Hsu, Tun-Wei
    Johansson-Jöesaar, Mats
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. Seco Tools AB, SE-737 82 Fagersta, Sweden.
    Andersson, Jon M.
    Seco Tools AB, SE-737 82 Fagersta, Sweden.
    Henrion, Gérard
    Institute Jean Lamour, Campus ARTEM, University of Lorraine, CNRS, F-54011 Nancy, France.
    Johnson, Lars J. S.
    Sandvik Coromant, SE-126 80 Stockholm, Sweden.
    Mücklich, Frank
    Department of Materials Science and Engineering, D3.3 Saarland University, D-66123 Saarbrücken, Germany.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    The Effect of Cathodic Arc Guiding Magnetic Field on the Growth of (Ti0.36Al0.64)N Coatings2019Inngår i: Coatings, ISSN 2079-6412, Vol. 9, nr 10, artikkel-id 660Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    We use a modified cathodic arc deposition technique, including an electromagnetic coil that introduces a magnetic field in the vicinity of the source, to study its influence on the growth of (Ti0.36Al0.64)N coatings. By increasing the strength of the magnetic field produced by the coil, the cathode arc spots are steered toward the edge of the cathode, and the electrons are guided to an annular anode surrounding the cathode. As a result, the plasma density between the cathode and substrate decreased, which was observed as a lateral spread of the plasma plume, and a reduction of the deposition rate. Optical emission spectroscopy shows reduced intensities of all recorded plasma species when the magnetic field is increased due to a lower number of collisions resulting in excitation. We note a charge-to-mass ratio decrease of 12% when the magnetic field is increased, which is likely caused by a reduced degree of gas phase ionization, mainly through a decrease in N2 ionization. (Ti0.36Al0.64)N coatings grown at different plasma densities show considerable variations in grain size and phase composition. Two growth modes were identified, resulting in coatings with (i) a fine-grained glassy cubic and wurtzite phase mixture when deposited with a weak magnetic field, and (ii) a coarse-grained columnar cubic phase with a strong magnetic field. The latter conditions result in lower energy flux to the coating’s growth front, which suppresses surface diffusion and favors the formation of c-(Ti,Al)N solid solutions over phase segregated c-TiN and w-AlN.

  • 11.
    Calamba, Katherine
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. Univ Lorraine, France.
    Jöesaar Johansson, Mats
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. SECO Tools AB, Sweden.
    Bruyere, S.
    Univ Lorraine, France.
    Pierson, J. F.
    Univ Lorraine, France.
    Boyd, Robert
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Plasma och beläggningsfysik. Linköpings universitet, Tekniska fakulteten.
    Andersson, J. M.
    SECO Tools AB, Sweden.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    The effect of nitrogen vacancies on initial wear in arc deposited (Ti-0.52,Ti- Al-0.48)N-y, (y < 1) coatings during machining2019Inngår i: Surface & Coatings Technology, ISSN 0257-8972, E-ISSN 1879-3347, Vol. 358, s. 452-460Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    Nitrogen deficient c-(Ti0.52Al0.48)Ny, y = 0.92, y = 0.87, and y = 0.75 coatings were prepared in different N-2/Ar discharges on WC-Co inserts by reactive cathodic arc deposition. The microstructure of the y = 0.92 coating show that spinodal decomposition has occurred resulting in the formation of coherent c-TiN- and c-AIN rich domains during cutting. The y = 0.87 and y = 0.75 coatings have exhibited a delay in decomposition due to the presence of nitrogen vacancies that lowers the free energy of the system. In the decomposed structure, grain boundaries and misfit dislocations enhance the diffusion of elements from the workpiece and the substrate (e.g. Fe, Cr, and Co) into the coatings and it becomes more susceptible to crater wear. The y = 0.87 sample displays the highest crater wear resistance because of its dense grain boundaries that prevent chemical wear. The y = 0.92 sample has the best flank wear resistance because the decomposition results in age hardening. The y = 0.75 sample contains the MAX-phase Ti(2)AIN after cutting. The chemical alteration within the y = 0.75 sample and its high amount of macroparticles cause its low wear resistance. The different microstructure evolution caused by different amount of N-vacancies result in distinctive interactions between chip and coating, which also causes difference in the initial wear mechanism of the (Ti,Al)/N-y coatings.

  • 12.
    Greczynski, Grzegorz
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten.
    Hultman, Lars
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    X-ray photoelectron spectroscopy studies of Ti1-xAlxN (0 <= x <= 0.83) high-temperature oxidation: The crucial role of Al concentration2019Inngår i: Surface & Coatings Technology, ISSN 0257-8972, E-ISSN 1879-3347, Vol. 374, s. 923-934Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    The resistance to high-temperature oxidation of Ti1-xAlxN films determines performance in numerous applications including coated cutting tools. Here, we present a comprehensive study covering Ti1-xAlxN films with 0 amp;lt;= x amp;lt;= 0.83 annealed in air for 1 h at temperatures T-a ranging from 500 to 800 degrees C. Layers are grown by the combination of high-power impulse and dc magnetron sputtering (HiPIMS/DCMS) in Ar/N-2 atmospheres. We use X-ray photoelectron spectroscopy to study the evolution of surface chemistry and to reconstruct elemental distribution profiles. No dependence of oxidation process on the phase content, average grain size, or preferred orientation could be confirmed, to the accuracy offered by the employed X-ray diffraction techniques. Instead, our results show that, under the applied test conditions, the Ti1-xAlxN oxidation scenario depends on both x and T-a. The common notion of double-layer Al2O3/TiO2 oxide formation is valid only in a limited region of the x-T-a parameter space (Type-1 oxidation). Outside this range, a mixed and non-conformal Al2O3-TiO2 layer forms, characterized by larger oxide thickness (Type-2 oxidation). The clear distinction between different Ti1-xAlxN oxidation scenarios revealed here is essential for numerous applications that can benefit from optimizing the Al content, while targeting a given operational temperature range.

  • 13.
    Chen, Yu-Hsiang
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Roa, J. J.
    Department of Materials Science and Metallurgical Engineering, Universitat Politècnica de Catalunya, Campus Diagonal Besòs-EEBE, 08019 Barcelona, Spain / Centre for Research in Multiscale Engineering of Barcelona, Universitat Politècnica de Catalunya, Campus Diagonal Besòs-EEBE, Barcelona, Spain.
    Chen, Yu-Hsiang
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Johansson-Jõesaar, Mats P.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Andersson, J. M.
    R&D Material and Technology Development, SECO Tools AB, SE-737 82 Fagersta, Sweden.
    Anglada, M. J.
    Department of Materials Science and Metallurgical Engineering, Universitat Politècnica de Catalunya, Campus Diagonal Besòs-EEBE, Barcelona, Spain / Centre for Research in Multiscale Engineering of Barcelona, Universitat Politècnica de Catalunya, Campus Diagonal Besòs-EEBE, Barcelona, Spain.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Rogström, Lina
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Enhanced thermal stability and fracture toughness of TiAlN coatings by Cr, Nb and V-alloying2018Inngår i: Surface & Coatings Technology, ISSN 0257-8972, E-ISSN 1879-3347, Vol. 342, s. 85-93Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    The effect of metal alloying on mechanical properties including hardness and fracture toughness were investigated in three alloys, Ti 0.33Al0.50(Me) 0.17N (Me = Cr, Nb and V), and compared to Ti0.50Al0.50N, in the as-deposited state and after annealing. All studied alloys display similar as-deposited hardness while the hardness evolution during annealing is found to be connected to phase transformations, related to the alloy’s thermal stability. The most pronounced hardening was observed in Ti0.50Al0.50N, while all the coatings with additional metal elements sustain their hardness better and they are harder than Ti0.50Al0.50N after annealing at 1100 °C. Fracture toughness properties were extracted from scratch tests. In all tested conditions, as-deposited and annealed at 900 and 1100 °C, Ti0.33Al0.50Nb0.17N show the least surface and sub-surface damage when scratched despite the differences in decomposition behavior and h-AlN formation. Theoretically estimated ductility of phases existing in the coatings correlates well with their crack resistance. In summary, Ti0.33Al0.50Nb0.17N is the toughest alloy in both as-deposited and post-annealed states.

    Fulltekst tilgjengelig fra 2020-02-17 16:38
  • 14.
    Björk, Emma
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. Univ Ulm, Germany.
    Mäkie, Peter
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Rogström, Lina
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Atakan, Aylin
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Schell, Norbert
    Helmholtz Zentrum Geesthacht, Germany.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Formation of block-copolymer-templated mesoporous silica2018Inngår i: Journal of Colloid and Interface Science, ISSN 0021-9797, E-ISSN 1095-7103, Vol. 521, s. 183-189Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    In situ attenuated total reflectance Fourier transform infrared spectroscopy is used to monitor the chemical evolution of the mesoporous silica SBA-15 from hydrolysis of the silica precursor to final silica condensation after the particle formation. Two silica precursors, tetraethyl orthosilicate (TEOS) or sodium metasilicate (SMS) were used, and the effects of additive (heptane and NH4F) concentrations were studied. Five formation stages are identified when TEOS is used as the precursor. The fourth stage correlates with the appearance and evolution of diffraction peaks recorded using in situ small angle X-ray diffraction. Details of the formed silica matrix are observed, e.g. the ratio between six-fold cyclic silica rings and linear bonding increases with the NH4F concentration. The TEOS hydrolysis time is independent of the NH4F concentration for small amounts of heptane, but is affected by the size of the emulsion droplets when the heptane amount increases. Polymerization and condensation rates of both silica precursors are affected by the salt concentration. Materials synthesized using SMS form significantly faster compared to TEOS-materials due to the pre-hydrolysis of the precursor. The study provides detailed insights into how the composition of the synthesis solution affects the chemical evolution and micellar aggregation during formation of mesoporous silica. (C) 2018 Elsevier Inc. All rights reserved.

    Fulltekst tilgjengelig fra 2020-03-13 13:33
  • 15.
    Tasnadi, Ferenc
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten. Natl Univ Sci and Technol MISIS, Russia.
    Rogström, Lina
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Zhu, Jianqiang
    Linköpings universitet, Institutionen för fysik, kemi och biologi. Linköpings universitet, Tekniska fakulteten.
    Wang, Fei
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten.
    Hsu, Tun-Wei
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Lind, Hans
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten.
    Abrikosov, Igor
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten. Natl Univ Sci and Technol MISIS, Russia.
    Johansson, Mats
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. SECO Tools AB, Sweden.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    High temperature thermodynamics of spinodal decomposition in arc deposited TixNbyAlzN coatings2018Inngår i: Materials & design, ISSN 0264-1275, E-ISSN 1873-4197, Vol. 150, s. 165-170Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    Using first principles calculations and experimental methods we show that B1 structured solid solution TixNbyAlzN can be grown. The mixing free energy surface indicates that the alloys should decompose. Theoretical analysis of the thermodynamic driving force towards the spinodal decomposition shows that the force can be different in alloys with equally low thermodynamic stability but different Nb content, indicating that the detailed picture of the decomposition should also be different. Electron microscopy and nanoindentation underlines different age hardening of the samples. We demonstrate that an alloy with the optimized composition, Ti0.42Nb0.17Al0.41N combines high thermal stability and age hardening behavior.

  • 16.
    Yang, Jie
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Biomolekylär och Organisk Elektronik. Linköpings universitet, Tekniska fakulteten. Univ Politecn Cataluna, Spain; AMES Sintered Met Components, Spain.
    Roa, J. J.
    Univ Politecn Cataluna, Spain; Univ Politecn Cataluna, Spain.
    Schwind, M.
    SECO Tools AB, Sweden.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Johansson-Jöesaar, Mats
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Esteve, J.
    Univ Barcelona, Spain.
    Llanes, L.
    Univ Politecn Cataluna, Spain; Univ Politecn Cataluna, Spain.
    Implementation of advanced characterisation techniques for assessment of grinding effects on the surface integrity of WC-Co cemented carbides2018Inngår i: Powder Metallurgy, ISSN 0032-5899, E-ISSN 1743-2901, Vol. 61, nr 2, s. 100-105Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    Grinding is a key step on the manufacturing process of WC-Co cemented carbides (hardmetals). In this work, an investigation of grinding effects on the surface integrity of hardmetals is conducted. It is done by combining diverse advanced characterisation techniques: X-ray diffraction, field emission-scanning electron microscopy, electron back scatter diffraction, focused ion beam - 3D tomography and transmission electron microscopy. The study is carried out in a fine-grained WC-Co grade. Besides ground state, polished surface finish condition is assessed for comparison purposes. It is evidenced that grinding induces significant alterations: 3D tomography illustrates microcracking exists down to 2.5 mu m depth with a highly anisotropic distribution at the subsurface, large compressive residual stresses extending until subsurface levels of about 12 mu m, and phase transformation of binder from the original fcc phase into the hcp one, as well as severe plastic deformation observed within the binder at the surface level.

  • 17.
    Jiao, Fei
    et al.
    Linköpings universitet, Institutionen för teknik och naturvetenskap, Laboratoriet för organisk elektronik. Linköpings universitet, Tekniska fakulteten.
    Edberg, Jesper
    Linköpings universitet, Institutionen för teknik och naturvetenskap, Laboratoriet för organisk elektronik. Linköpings universitet, Tekniska fakulteten.
    Zhao, Dan
    Linköpings universitet, Institutionen för teknik och naturvetenskap, Laboratoriet för organisk elektronik. Linköpings universitet, Tekniska fakulteten.
    Puzinas, Skomantas
    Linköpings universitet, Institutionen för teknik och naturvetenskap, Laboratoriet för organisk elektronik. Linköpings universitet, Tekniska fakulteten.
    Khan, Zia
    Linköpings universitet, Institutionen för teknik och naturvetenskap, Laboratoriet för organisk elektronik. Linköpings universitet, Tekniska fakulteten.
    Mäkie, Peter
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Naderi, Ali
    Innventia AB, Sweden.
    Lindstrom, Tom
    Innventia AB, Sweden.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Engquist, Isak
    Linköpings universitet, Institutionen för teknik och naturvetenskap, Laboratoriet för organisk elektronik. Linköpings universitet, Tekniska fakulteten.
    Berggren, Magnus
    Linköpings universitet, Institutionen för teknik och naturvetenskap, Laboratoriet för organisk elektronik. Linköpings universitet, Tekniska fakulteten.
    Crispin, Xavier
    Linköpings universitet, Institutionen för teknik och naturvetenskap, Laboratoriet för organisk elektronik. Linköpings universitet, Tekniska fakulteten.
    Nanofibrillated Cellulose-Based Electrolyte and Electrode for Paper-Based Supercapacitors2018Inngår i: ADVANCED SUSTAINABLE SYSTEMS, ISSN 2366-7486, Vol. 2, nr 1, artikkel-id UNSP 1700121Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    Solar photovoltaic technologies could fully deploy and impact the energy conversion systems in our society if mass-produced energy-storage solutions exist. A supercapacitor can regulate the fluctuations on the electrical grid on short time scales. Their mass-implementation requires the use of abundant materials, biological and organic synthetic materials are attractive because of atomic element abundancy and low-temperature synthetic processes. Nanofibrillated cellulose (NFC) coming from the forest industry is exploited as a three-dimensional template to control the transport of ions in an electrolyte-separator, with nanochannels filled of aqueous electrolyte. The nanochannels are defined by voids in the nanocomposite made of NFC and the proton transporting polymer polystyrene sulfonic acid PSSH. The ionic conductivity of NFC-PSSH composites (0.2 S cm(-1) at 100% relative humidity) exceeds sea water in a material that is solid, feel dry to the finger, but filled of nanodomains of water. A paper-based supercapacitor made of NFC-PSSH electrolyte-separator sandwiched between two paper-based electrodes is demonstrated. Although modest specific capacitance (81.3 F g(-1)), power density (2040 W kg(-1)) and energy density (1016 Wh kg(-1)), this is the first conceptual demonstration of a supercapacitor based on cellulose in each part of the device; which motivates the search for using paper manufacturing as mass-production of energy-storage devices.

  • 18.
    Tasnadi, Ferenc
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten. Natl Univ Sci and Technol MISIS, Russia.
    Wang, Fei
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten. Saarland Univ, Germany.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Abrikosov, Igor
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten. Natl Univ Sci and Technol MISIS, Russia.
    Thermal expansion of quaternary nitride coatings2018Inngår i: Journal of Physics: Condensed Matter, ISSN 0953-8984, E-ISSN 1361-648X, Vol. 30, nr 13, artikkel-id 135901Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    The thermal expansion coefficient of technologically relevant multicomponent cubic nitride alloys are predicted using the Debye model with ab initio elastic constants calculated at 0 K and an isotropic approximation for the Gruneisen parameter. Our method is benchmarked against measured thermal expansion of TiN and Ti(1-x)AlxN as well as against results of molecular dynamics simulations. We show that the thermal expansion coefficients of Ti(1-x-y)XyAlxN (X = Zr, Hf, Nb, V, Ta) solid solutions monotonously increase with the amount of alloying element X at all temperatures except for Zr and Hf, for which they instead decrease for y greater than or similar to 0.5.

  • 19.
    Atakan, Aylin
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Erdtman, Edvin
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Kemi. Linköpings universitet, Tekniska fakulteten.
    Mäkie, Peter
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Ojamäe, Lars
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Kemi. Linköpings universitet, Tekniska fakulteten.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Time evolution of the CO2 hydrogenation to fuels over Cu-Zr-SBA-15 catalysts2018Inngår i: Journal of Catalysis, ISSN 0021-9517, E-ISSN 1090-2694, Vol. 362, s. 55-64Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    Time evolution of catalytic CO2 hydrogenation to methanol and dimethyl ether (DME) has been investigated in a high-temperature high-pressure reaction chamber where products accumulate over time. The employed catalysts are based on a nano-assembly composed of Cu nanoparticles infiltrated into a Zr doped SiOx mesoporous framework (SBA-15): Cu-Zr-SBA-15. The CO2 conversion was recorded as a function of time by gas chromatography-mass spectrometry (GC-MS) and the molecular activity on the catalyst’s surface was examined by diffuse reflectance in-situ Fourier transform infrared spectroscopy (DRIFTS). The experimental results showed that after 14 days a CO2 conversion of 25% to methanol and DME was reached when a DME selective catalyst was used which was also illustrated by thermodynamic equilibrium calculations. With higher Zr content in the catalyst, greater selectivity for methanol and a total 9.5% conversion to methanol and DME was observed, yielding also CO as an additional product. The time evolution profiles indicated that DME is formed directly from methoxy groups in this reaction system. Both DME and methanol selective systems show the thermodynamically highest possible conversion.

  • 20.
    Dalibon, Eugenia L.
    et al.
    University of Tecnol Nacl UTN FRCU, Argentina.
    Ghafoor, Naureen
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten.
    Rogström, Lina
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Trava-Airoldi, Vladimir J.
    INPE, Brazil.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Bruhl, Sonia P.
    University of Tecnol Nacl UTN FRCU, Argentina.
    Carbon Based Coatings Deposited on Nitrided Stainless Steel: Study of Thermal Degradation2017Inngår i: PROCEEDINGS OF THE 3RD PAN AMERICAN MATERIALS CONGRESS, SPRINGER INTERNATIONAL PUBLISHING AG , 2017, s. 57-66Konferansepaper (Fagfellevurdert)
    Abstract [en]

    Amorphous hydrogenated carbon (DLC) coatings have a high hardness depending on the relative amount of sp(3)/sp(2) bondings. They also exhibit an extremely low friction coefficient and are chemically inert. However, these coatings have some disadvantages which limit their applications. For instance, adhesion is poor when they are deposited on metallic substrates and they are also unstable at high temperatures, degrading into graphite and loosing hardness. In this work, DLC coatings were deposited on precipitation hardening stainless steel (PH Corrax) which was plasma nitrided before the coating deposition. The samples were submitted to annealing treatments for an hour at different temperatures from 200 to 600 degrees C, together with a control group, which was only coated but not nitrided. After each annealing cycle, Raman Spectroscopy, nanoindentation and microscopy were used to check film properties. It was demonstrated that the nitriding pre treatment improved not only adhesion but also the thermal stability of the DLC, slowing degradation and preventing delamination.

  • 21.
    Zuo, Xiao
    et al.
    Chinese Academic Science, Peoples R China; Chinese Academic Science, Peoples R China.
    Ke, Peiling
    Chinese Academic Science, Peoples R China; Chinese Academic Science, Peoples R China.
    Chen, Rende
    Chinese Academic Science, Peoples R China.
    Li, Xiaowei
    Chinese Academic Science, Peoples R China.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Wang, Aiying
    Chinese Academic Science, Peoples R China; Chinese Academic Science, Peoples R China.
    Discharge state transition and cathode fall thickness evolution during chromium HiPIMS discharge2017Inngår i: Physics of Plasmas, ISSN 1070-664X, E-ISSN 1089-7674, Vol. 24, nr 8, artikkel-id 083507Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    The temporal evolutions of target voltage and current waveforms under different pulse voltage and working pressure conditions were studied during Cr high power impulse magnetron sputtering discharges. Target voltage and current characteristics demonstrated that when the pulse width was set as 200 mu s, HiPIMS discharge went through a four-stage sequence during each pulse, Townsend discharge, glow discharge, afterglow, and pulse-off stages. A discharge state transition in the glow discharge stage happened at high pulse voltage and working pressure conditions. Furthermore, the dependence of reduced cathode fall thickness pdcon pulse voltage, working pressure, and normalized current density j/p(2) was presented. It was found that gas rarefaction leads to a change of relationship between pd(c) and j/p(2). A noticeable increase of the cathode fall thickness caused by gas rarefaction has been found. Published by AIP Publishing.

  • 22.
    Chen, Yu-Hsiang
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Rongström, L.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Ostach, D.
    HZG, Germany.
    Ghafoor, Naureen
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Johansson-Jöesaar, Mats P
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. SECO Tools AB, Sweden.
    Schell, N.
    HZG, Germany.
    Birch, Jens
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Effects of decomposition route and microstructure on h-AlN formation rate in TiCrAlN alloys2017Inngår i: Journal of Alloys and Compounds, ISSN 0925-8388, E-ISSN 1873-4669, Vol. 691, s. 1024-1032Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    The phase evolution of cubic (c), solid solution TixCr-0.37Al1-0.37-x N alloys with x = 0.03 and 0.16, and the kinetics of the hexagonal (h)-AlN formation are studied via in situ wide angle x-ray scattering experiments during high temperature (1000-1150 degrees C) annealing. Spinodal decomposition was observed in Ti0.16Cr0.36Al0.48N while Ti0.03Cr0.38Al0.59N decomposes through nucleation and growth of h-AlN, c-TiN and c-CrAlN. h-AlN is formed from c-CrAlN domains in both cases and the formation rate of h-AlN depends on the stability of the c-CrAlN domains. In Ti0.16Cr0.36Al0.48N, the c-CrAlN domains are stabilized by crystallographic coherency with the surrounding c-TiCrN in a microstructure originating from spinodal decomposition. This results in lower formation rates of h-AlN for this composition. These differences are reflected in higher activation energy for h-AlN formation in Ti0.16Cr0.36Al0.48N compared to Ti0.03Cr0.38Al0.59N. It also points out different stabilities of the intermediate phase c-CrAlN during phase decomposition of TiCrAlN alloys. Additional contributions to the low activation energy for formation of h-AlN in Ti0.03Cr0.38Al0.59N stems from precipitation at grain boundaries. (C) 2016 Elsevier B.V. All rights reserved.

  • 23.
    Schramm, Isabella C.
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Pauly, C.
    Functional Materials, Department Materials Science, Saarland University, Saarbrucken, Germany.
    Johansson Jõesaar, Mats P.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. SECO Tools AB, Fagersta, Sweden.
    Slawik, S.
    Functional Materials, Department Materials Science, Saarland University, Saarbrucken, Germany.
    Suarez, S.
    Functional Materials, Department Materials Science, Saarland University, Saarbrucken, Germany.
    Mücklich, F.
    Functional Materials, Department Materials Science, Saarland University, Saarbrucken, Germany.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Effects of nitrogen vacancies on phase stability and mechanical properties of arc deposited (Ti0.52Al0.48)Ny (y<1) coatings2017Inngår i: Surface & Coatings Technology, ISSN 0257-8972, E-ISSN 1879-3347, Vol. 330, nr Supplement C, s. 77-86Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    Nitrogen sub-stoichiometric (Ti0.52Al0.48)Ny (0.92 ≥ y  ≥ 0.46) coatings were grown in a mixed Ar/N2 atmosphere by cathodic arc deposition on cemented carbide (WC/Co-based) substrates. The coatings present a columnar structure with decreasing column widths from 250 to 60nm, due to a corresponding reduced N content, accompanied by changes in preferred orientation from 200 to 111 to 220. Among these, coatings prepared with 0.92≥y≥0.75 exhibit spinodal decomposition and consequently age hardening at elevated temperatures. A reduced N content upshifts the hardness maximum by >300 °C. For these samples, the high temperature treatment resulted in interdiffusion of substrate elements, Co and C, mainly along column boundaries. Nevertheless, no detrimental effect in the hardness could be correlated. Conversely, a low N content sample (y=0.46) presents significant lattice diffusion of substrate elements Co, C, W, and Ta in the coating. In this case, the substrate elements are present throughout the coating, forming additional phases such as c-Ti(C,N), c-Co(Al,Ti,W), and c-(Ti,W,Ta)(C,N), with an observed increased hardness from 16 to 25GPa. We suggest that the substitution of nitrogen by carbon and the solution of W and Ta in c-TiN are responsible for the observed hardening. Our investigation shows the potential of sub-stoichiometric (Ti1-xAlx)Ny coatings for high temperature applications such as cutting tools and puts forth corresponding criteria for N content selection.

  • 24.
    Calamba, Katherine
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. University of Lorraine, France.
    Schramm, Isabella
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. Saarland University, Germany.
    Johansson Jöesaar, Mats P.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. SECO Tools AB, Sweden.
    Ghanbaja, J.
    University of Lorraine, France.
    Pierson, J. F.
    University of Lorraine, France.
    Mucklich, F.
    Saarland University, Germany.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Enhanced thermal stability and mechanical properties of nitrogen deficient titanium aluminum nitride (Ti0.54Al0.46Ny) thin films by tuning the applied negative bias voltage2017Inngår i: Journal of Applied Physics, ISSN 0021-8979, E-ISSN 1089-7550, Vol. 122, nr 6, artikkel-id 065301Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    Aspects on the phase stability and mechanical properties of nitrogen deficient (Ti0.54Al0.46)N-y alloys were investigated. Solid solution alloys of (Ti,Al)N were grown by cathodic arc deposition. The kinetic energy of the impinging ions was altered by varying the substrate bias voltage from -30V to -80 V. Films deposited with a high bias value of -80V showed larger lattice parameter, finer columnar structure, and higher compressive residual stress resulting in higher hardness than films biased at -30V when comparing their as-deposited states. At elevated temperatures, the presence of nitrogen vacancies and point defects (anti-sites and self-interstitials generated by the ion-bombardment during coating deposition) in (Ti0.54Al0.46)N-0.87 influence the driving force for phase separation. Highly biased nitrogen deficient films have point defects with higher stability during annealing, which cause a delay of the release of the stored lattice strain energy and then accelerates the decomposition tendencies to thermodynamically stable c-TiN and w-AlN. Low biased nitrogen deficient films have retarded phase transformation to w-AlN, which results in the prolongment of age hardening effect up to 1100 degrees C, i.e., the highest reported temperature for Ti-Al-N material system. Our study points out the role of vacancies and point defects in engineering thin films with enhanced thermal stability and mechanical properties for high temperature hard coating applications. Published by AIP Publishing.

  • 25.
    Yalamanchili, K.
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi. Linköpings universitet, Tekniska fakulteten.
    Wang, Fei
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten. Saarland University, Germany.
    Schramm, Isabella
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. Saarland University, Germany.
    Andersson, J. M.
    Seco Tools AB, Sweden.
    Johansson Jöesaar, Mats P.
    Linköpings universitet, Institutionen för fysik, kemi och biologi. Linköpings universitet, Tekniska fakulteten. Seco Tools AB, Sweden.
    Tasnadi, Ferenc
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten.
    Muecklich, F.
    Saarland University, Germany.
    Ghafoor, Naureen
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Exploring the high entropy alloy concept in (AlTiVNbCr)N2017Inngår i: Thin Solid Films, ISSN 0040-6090, E-ISSN 1879-2731, Vol. 636, s. 346-352Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    We have explored the high entropy alloy (HEA) concept in the AlTiVNbCr-nitride material system. (AlTiVNbCr)N coatings synthesized by reactive cathodic arc deposition are close to an ideal cubic solid solution with a positive mean-field enthalpy of mixing of 0.06 eV/atom. First principle calculations showa higher thermodynamic stability for the solid solution relative to their binaries thereby indicating a possible entropy stabilization at a temperature above 727 degrees C. However, the elevated temperature annealing experiments show that the solid solution decomposes to w-AlN and c-(TiVNbCr)N. The limited thermal stability of the solid solution is investigated in relation to several thermodynamic parameters. We suggest that the HEA designed multiprincipal element (AlTiVNbCr) N solid solutions are in a metastable state. (C) 2017 Published by Elsevier B.V.

  • 26.
    Yang, Jie
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Biomolekylär och Organisk Elektronik. Linköpings universitet, Tekniska fakulteten. University of Politecn Cataluna, Spain.
    Roa, J. J.
    University of Politecn Cataluna, Spain; University of Politecn Cataluna, Spain.
    Schwin, M.
    SECO Tools AB, Sweden.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Johansson, Mats
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. SECO Tools AB, Sweden.
    Llanes, L.
    University of Politecn Cataluna, Spain; University of Politecn Cataluna, Spain.
    Grinding-induced metallurgical alterations in the binder phase of WC-Co cemented carbides2017Inngår i: Materials Characterization, ISSN 1044-5803, E-ISSN 1873-4189, Vol. 134, s. 302-310Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    The metallic binder phase dictates the toughening behavior of WC-Co cemented carbides (hardmetals), even though it occupies a relative small fraction of the composite. Studies on deformation and phase transformation of the binder constituent are scarce. Grinding represents a key manufacturing step in machining of hardmetal tools, and is well-recognized to induce surface integrity alterations. In this work, metallurgical alterations of the binder phase in ground WC-Co cemented carbides have been assessed by a combination of electron back scattered diffraction and transmission electron microscopy techniques. The Co-base binder experiences a martensitic phase transformation from fcc to hcp crystal structure, predominantly in the first 5 mu m below the surface. The hcp fraction decreases gradually along a depth of 10 mu m. Surface Co displays severe plastic deformation under the highest strain, resulting in formation of nanocrystalline grains in the first micrometer below the surface. Microstructural refinement within the binder phase is observed even at greater depth. Stacking faults were detected in most of the refined grains. The metallurgical alterations of the binder phase modify the local stress distribution during grinding, which affects the discerned subsurface microcracking. The resulting residual stress profile is the sum of multiple subsurface changes, such as phase transformation, severe plastic deformation and grain refinement, where it is discerned that the depth profile of the transformed hcp-Co fraction coincides with the grinding-induced residual stress profile.

  • 27.
    Yang, J.
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. University of Politecn Cataluna, Spain; Pol Ind Les Fallulles, Spain.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Johansson-Joesaar, M. P.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. SECO Tools AB, Sweden.
    Esteve, J.
    University of Barcelona, Spain.
    Llanes, L.
    University of Politecn Cataluna, Spain; University of Politecn Cataluna, Spain.
    Mechanical strength of ground WC-Co cemented carbides after coating deposition2017Inngår i: Materials Science & Engineering: A, ISSN 0921-5093, E-ISSN 1873-4936, Vol. 689, s. 72-77Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    Manufacturing of hardmetal tools often involves surface grinding, ion etching and final coating. Each stage throughout the manufacturing chain introduces surface integrity changes which may be critical for defining the final mechanical behavior of the coated tools. Within this context, an experimental test program has been developed to assess the influence of a coating (TiN) deposition on surface integrity and transverse rupture strength of a previously ground fine-grained WC-Co grade substrate. Four different substrate surface finish conditions (prior to ion etching and coating) were evaluated: as sintered (AS), ground (G), polished (P), and ground plus high temperature annealing (GTO. Surface integrity and fracture resistance characterization, complemented with a detailed fractographic analysis, were performed on both uncoated and coated samples. Results show that the surface integrity after grinding has been partly modified during the ion etching and film deposition processes, particularly in terms of a reduced compressive residual stress state at the substrate surface level. Consequently, the grinding induced strength enhancement in hardmetals is reduced for coated specimens. Main reason behind it is the change of nature, location and stress state acting on critical flaw: from processing defects existing at the subsurface (uncoated G specimens) to grinding-induced microcracks located close to the interface between coating and substrate, but within the subsurface of the latter (coated G specimens). This is not the case for AS and P conditions, where flexural strength does not change a result of ion etching and coating. Finally, fracture resistance increases slightly for GTT specimens after coating process, possibly caused by a beneficial effect of the deposited film on the residual stress state at the surface.

  • 28.
    Björk, Emma
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. University of Nacl Rio Cuarto, Argentina.
    Militello, Maria P.
    University of Nacl Rio Cuarto, Argentina.
    Tamborini, Luciano H.
    University of Nacl Rio Cuarto, Argentina.
    Coneo Rodriguez, Rusbel
    University of Nacl Rio Cuarto, Argentina.
    Planes, Gabriel A.
    University of Nacl Rio Cuarto, Argentina.
    Acevedo, Diego F.
    University of Nacl Rio Cuarto, Argentina; University of Nacl Rio Cuarto, Argentina.
    Sergio Moreno, M.
    Consejo Nacl Invest Cient and Tecn, Argentina.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Barbero, Cesar A.
    University of Nacl Rio Cuarto, Argentina.
    Mesoporous silica and carbon based catalysts for esterification and biodiesel fabrication-The effect of matrix surface composition and porosity2017Inngår i: Applied Catalysis A: General, ISSN 0926-860X, E-ISSN 1873-3875, Vol. 533, s. 49-58Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    The effects of catalyst matrix porosity composition on the catalytic performance have been studied using sulfonated mesoporous SBA-15 silica. The matrix was sulfonated with three different methods grafting, in situ oxidation, and carbon infiltration. Additionally, unordered sulfonated mesoporous carbon, and the commercial catalysts Amberlite IR-120 and Nafion 117 were tested. The catalytic performance was evaluated in a Fischer esterification using acetic acid and ethanol, as well as in a transesterification of triglycerides (sunflower oil) and ethanol to produce biodiesel. The study shows that for long carbon chains, the effective wetting of the porous catalyst matrix by the reactants is most important for the catalytic efficiency, while for shorter carbon chain, the mass transport of the reagents trough the porous structure is more important. The catalysts were analysed using electron microscopy and physisorption. The study shows that the reactions are faster with carbon infiltrated materials than the silica materials due to a higher concentration of sulfonic groups linked to the carbon. The in situ functionalized SBA-15 is a more efficient catalyst compared to the post grafted one. All the synthesized catalysts outperform the commercial ones in both reactions in terms of conversion. (C) 2017 Elsevier B.V. All rights reserved.

  • 29.
    Syed, Bilal
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Zhu, Jianqiang
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Polcik, Peter
    PLANSEE Composite Materials GmbH, Germany.
    Kolozsvari, Szilard
    PLANSEE Composite Materials GmbH, Germany.
    Håkansson, Greger
    Ionbond Sweden AB, Sweden.
    Johnson, Lars
    Sandvik Coromant, Stockholm, Sweden.
    Ahlgren, Mats
    Sandvik Coromant, Stockholm, Sweden.
    Jöessar, Mats
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. Seco Tools AB, Fagersta, Sweden.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Morphology and microstructure evolution of Ti-50 at.% Al cathodes during cathodic arc deposition of Ti-Al-N coatings2017Inngår i: Journal of Applied Physics, ISSN 0021-8979, E-ISSN 1089-7550, Vol. 121, nr 24, artikkel-id 245309 (2017)Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    Today's research on the cathodic arc deposition technique and coatings therefrom primarily focuses on the effects of, e.g., nitrogen partial pressure, growth temperature, and substrate bias. Detailed studies on the morphology and structure of the starting material—the cathode—during film growth and its influence on coating properties at different process conditions are rare. This work aims to study the evolution of the converted layer, its morphology, and microstructure, as a function of the cathode material grain size during deposition of Ti-Al-N coatings. The coatings were reactively grown in pure N2discharges from powder metallurgically manufactured Ti-50 at.% Al cathodes with grain size distribution averages close to 1800, 100, 50, and 10 μm, respectively, and characterized with respect to microstructure, composition, and mechanical properties. The results indicate that for the cathode of 1800 μm grain size the disparity in the work function among parent phases plays a dominant role in the pronounced erosion of Al, which yields the coatings rich in macro-particles and of high Al content. We further observed that a reduction in the grain size of Ti-50 at.% Al cathodes to 10 μm provides favorable conditions for self-sustaining reactions between Ti and Al phases upon arcing to form γ phase. The combination of self-sustaining reaction and the arc process not only result in the formation of hole-like and sub-hole features on the converted layer but also generate coatings of high Al content and laden with macro-particles.

  • 30.
    Tasnadi, Ferenc
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten.
    Lugovskoy, Andrey V.
    NUST MISIS, Russia.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Abrikosov, Igor
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten. NUST MISIS, Russia.
    Non-equilibrium vacancy formation energies in metastable alloys - A case study of Ti0.5Al0.5N2017Inngår i: MATERIALS and DESIGN, ISSN 0264-1275, Vol. 114, s. 484-493Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    In this study, we present a computational technique to investigate non-equilibrium vacancies in metastable alloys. In contrast to equilibrium materials, calculation of the energy of removing an alloying atom requires a finite size configurational correction. We explain that in metastable alloys the vacancy formation energy is defined up to an arbitrary constant. We argue that in non-equilibrium alloys no statistical considerations are required and there is a distribution of the vacancy formation energy with large variation. We show for the example of Ti0.5Al0.5N that the configuration correction is significant. Using cluster expansion, we demonstrate the major importance of the first two metallic coordination shells in Ti0.5Al0.5N. We introduce a three-dimensional representation of the energies of removing Ti and Al atoms as a function of number of Al atoms in the neighboring shells and we predict the metal atom vacancy formation energy in arbitrary local chemical environments. Neglecting the interactions between the vacant sites and assuming their simultaneous occurrence, we show how to extract information about the energy cost of a vacancy concentration in metastable alloys. We conclude that in metastable disordered alloys vacancies should occur in local environments that correspond to the lowest formation energies rather than distributed statistically. (C) 2016 Elsevier Ltd. All rights reserved.

  • 31.
    Schramm, Isabella
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. Saarland University, Germany.
    Pauly, C.
    Saarland University, Germany.
    Johansson Jöesaar, Mats P
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. SECO Tools AB, Sweden.
    Eklund, Per
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten.
    Schmauch, J.
    Saarland University, Germany.
    Muecklich, F.
    Saarland University, Germany.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Solid state formation of Ti4AlN3 in cathodic arc deposited (Ti1-xAlx)N-y alloys2017Inngår i: Acta Materialia, ISSN 1359-6454, E-ISSN 1873-2453, Vol. 129, s. 268-277Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    Reactive cathodic arc deposition was used to grow substoichiometric solid solution cubic c-(Ti1-xAlx)N-y thin films. The films were removed from the substrate and then heated in an argon environment to 1400 degrees C. Via solid state reactions, formation of MAX phase Ti4AlN3 was obtained. Additional phases such as Ti2AlN, c-TiN, w-AIN, Al5Ti2 and Al3Ti were also present during the solid state reaction. Ti4AlN3 formation was observed in samples with an Al metal fraction x amp;lt; 0.63 and a nitrogen content 0.4 amp;lt; y amp;lt; 0.6. Regardless of the initial composition, formation of Ti4AlN3 started in Ti2AlN crystal plates in the temperature range between 1200 and 1400 degrees C. Accompanying the onset of Ti4AlN3 was the presence of an intermediate structure identified as Ti6Al2N4, consisting of alternating layers of intergrown Ti2AlN and Ti4AlN3 phases with a half-unit-cell stacking. We suggest that the formation of Ti4AlN3 occurred via intercalation of aluminum and nitrogen along the basal plane accompanied by a simultaneous detwinning process. In addition we propose that this formation mechanism can be used to obtain MAX phases of high n order. (C) 2017 Acta Materialia Inc. Published by Elsevier Ltd. All rights reserved.

  • 32.
    Atakan, Aylin
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Mäkie, Peter
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Söderlind, Fredrik
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Kemi. Linköpings universitet, Tekniska fakulteten.
    Keraudy, Julien
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Plasma och beläggningsfysik. Linköpings universitet, Tekniska fakulteten.
    Johansson, Emma
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Synthesis of a Cu-infiltrated Zr-doped SBA-15 catalyst for CO2 hydrogenation into methanol and dimethyl ethert2017Inngår i: Physical Chemistry, Chemical Physics - PCCP, ISSN 1463-9076, E-ISSN 1463-9084, Vol. 19, nr 29, s. 19139-19149Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    A catalytically active nanoassembly comprising Cu-nanoparticles grown on integrated and active supports (large pore Zr-doped mesoporous SBA-15 silica) has been synthesized and used to promote CO2 hydrogenation. The doped mesoporous material was synthesized using a sal-gel method, in which the pore size was tuned between 11 and 15 nm while maintaining a specific surface area of about 700 m(2) g (1). The subsequent Cu nanoparticle growth was achieved by an infiltration process involving attachment of different functional groups on the external and internal surfaces of the mesoporous structure such that 7-10 nm sized Cu nanoparticles grew preferentially inside the pores. Chemisorption showed improved absorption of both CO2 and H-2 for the assembly compared to pure SBA-15 and 15% of the total CO2 was converted to methanol and dimethyl ether at 250 degrees C and 33 bar.

  • 33.
    Wang, Fei
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten. University of Saarland, Germany.
    Holec, David
    University of Leoben, Austria.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Muecklich, Frank
    University of Saarland, Germany.
    Abrikosov, Igor
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten. NUST MISIS, Russia.
    Tasnadi, Ferenc
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten.
    Systematic ab initio investigation of the elastic modulus in quaternary transition metal nitride alloys and their coherent multilayers2017Inngår i: Acta Materialia, ISSN 1359-6454, E-ISSN 1873-2453, Vol. 127, s. 124-132Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    We give a comprehensive overview of the elastic properties of cubic quaternary transition metal nitride alloys and coherent nitride multilayers for design of wear resistant hard coatings. The elastic stiffness constants of the alloys are calculated using the special quasirandom structure method. For multilayers with sharp interfaces we prove the applicability of a linear-elasticity approximation and show that it can be used with success instead of performing direct computationally demanding ab initio calculations. We explore the trends and the potential of multicomponent alloying in engineering the strength and ductility of both, quaternary alloys and their multilayers. We investigate X(i-x-y)TixAlyN alloys where Xis Zr, Hf, V, Nb or Ta, and present an analysis based on increasing x. We show that with increasing Ti content ductility can increase in each alloy. Elastic isotropy is observed only in (Zr,Hf,V)((i-x-y))TixAlyN alloys in the middle of the compositional triangle, otherwise a high Youngs modulus is observed along [001]. We predict that coherent TiN/X(1-x-y)TixAlyN and ZrN/X(i-x-3)TixAlyN alloy multilayers with the [111] interfacial direction show increasing ductility with increasing x, while the multilayers with the [001] orientation become more brittle. We show that the Youngs moduli variation in the parent bulk quaternary nitride alloy provide a reliable descriptor to screen the Youngs modulus of coherent multilayers in high-throughput calculations. (C) 2017 Acta Materialia Inc. Published by Elsevier Ltd. All rights reserved.

  • 34.
    Zhang, Shucan
    et al.
    Chinese Academic Science, Peoples R China.
    Wang, Zhenyu
    Chinese Academic Science, Peoples R China.
    Guo, Peng
    Chinese Academic Science, Peoples R China.
    Ke, Peiling
    Chinese Academic Science, Peoples R China.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Wang, Aiying
    Chinese Academic Science, Peoples R China.
    Temperature induced superhard CrB2 coatings with preferred (001) orientation deposited by DC magnetron sputtering technique2017Inngår i: Surface & Coatings Technology, ISSN 0257-8972, E-ISSN 1879-3347, Vol. 322, s. 134-140Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    The influence of deposition temperature in the range of 100 degrees C to 400 degrees C on the microstructure and mechanical properties of CrB2 coatings by DC magnetron sputtering was studied. The coating texture changed from random mixed orientation with (101) and (001) planes to the preferred (001) orientation when increasing the deposition temperature. Moreover, the microstructure coating evolved from an underdense structure to a bulky columnar structure (similar to 50 nm), and finally to a dense nanoscale columnar structure (similar to 7 nm). This structural densification was mainly attributed to the enhanced atomic surface diffusion with increasing deposition temperature. It resulted in promotion of the (001) preferred orientation and greatly enhanced the mechanical properties. Specifically, when the deposition temperature was 300 degrees C, the CrB2 coatings exhibited the highest toughness while superhardness (51 +/- 2 GPa) was achieved for coating grown at 400 degrees C. (C) 2017 Published by Elsevier B.V.

  • 35.
    Chen, Yu-Hsiang
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Rogström, Lina
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Roa, JJ
    Departament de Ciència dels Materials i Enginyería Metal·lúrgica, Universitat Politècnica de Catalunya, EEBE-Campus Diagonal Besòs, Barcelona, Spain.
    Zhu, Jianqiang
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Schramm, Isabella
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. Functional Materials, Department of Materials Science, Campus D3.3, Saarland University,Saarbrücken, Germany.
    Johnson, LJS
    Sandvik Coromant, SE-126 80 Stockholm, Sweden.
    Schell, N.
    Helmholtz-Zentrum Geesthacht (HZG), Geesthacht, Germany.
    Muecklich, F.
    Functional Materials, Department of Materials Science, Campus D3.3, Saarland University, Saarbrücken, Germany.
    Anglada, M. J.
    Departament de Ciència dels Materials i Enginyería Metal·lúrgica, Universitat Politècnica de Catalunya, EEBE-Campus Diagonal Besòs, Barcelona, Spain.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Thermal and mechanical stability of wurtzite-ZrA1N/cubic-TiN and wurtzite-ZrA1N/cubic-ZrN multilayers2017Inngår i: Surface & Coatings Technology, ISSN 0257-8972, E-ISSN 1879-3347, Vol. 324, s. 328-337Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    The phase stability and mechanical properties of wurtzite (w)-Zr(0.25)A1(0.75)N/cubic (c)-TiN and w-Zr(0.25)A1(0.75)N/c-ZrN multilayers grown by arc evaporation are studied. Coherent interfaces with an orientation relation of c-TiN (111)[1-10]IIw-ZrAlN (0001)[11-20] form between ZrA1N and TiN sublayers during growth of the w-ZrAIN/c-TiN multilayer. During annealing at 1100 degrees C a c-Ti(Zr)N phase forms at interfaces between ZrA1N and TiN, which reduces the lattice mismatch so that the coherency and the compressive strain are partially retained, resulting in an increased hardness (32 GPa) after annealing. For the w-ZrAIN/c-ZrN multilayer, there is no coherency between sublayers leading to strain relaxation during annealing causing the hardness to drop. The retained coherency between layers and the compressive strain in the w-ZrAIN/c-TiN multilayer results in superior fracture toughness compared to the w-ZrAIN/c-ZrN multilayer as revealed by cross-sectional investigations of damage events under scratch and indentation tests. (C) 2017 Elsevier B.V. All rights reserved.

  • 36.
    Barrirero, Jenifer
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi. Linköpings universitet, Tekniska fakulteten. University of Saarland, Germany.
    Li, Jiehua
    University of Leoben, Austria.
    Engstler, Michael
    University of Saarland, Germany.
    Ghafoor, Naureen
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Schumacher, Peter
    University of Leoben, Austria.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Muecklich, Frank
    University of Saarland, Germany.
    Cluster formation at the Si/liquid interface in Sr and Na modified Al-Si alloys2016Inngår i: Scripta Materialia, ISSN 1359-6462, E-ISSN 1872-8456, Vol. 117, s. 16-19Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    Atom probe tomography was used to compare Na and Sr modified Al-Si hypoeutectic alloys. Both Na and Sr promote the formation of nanometre-sized clusters in the Si eutectic phase. Compositional analyses of the clusters show an Al:Sr ratio of 2.92 +/- 0.46 and an Al:Na ratio of 1.07 +/- 0.23. It is proposed that SrAl2Si2 and NaAlSi clusters are formed at the Si/liquid interface and take part in the modification process by altering the eutectic Si growth.

  • 37.
    Wang, Fei
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten. University of Saarland, Germany.
    Abrikosov, Igor
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten. NUST MISIS, Russia; Tomsk State University, Russia.
    Simak, Sergey
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Muecklich, Frank
    University of Saarland, Germany.
    Tasnadi, Ferenc
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten.
    Coherency effects on the mixing thermodynamics of cubic Ti1-xAlxN/TiN(001) multilayers2016Inngår i: PHYSICAL REVIEW B, ISSN 2469-9950, Vol. 93, nr 17, s. 174201-Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    In this work, we discuss the mixing thermodynamics of cubic (B1) Ti1-xAlxN/TiN(001) multilayers. We show that interfacial effects suppress the mixing enthalpy compared to bulk Ti1-xAlxN. The strongest stabilization occurs for compositions in which the mixing enthalpy of bulk Ti1-xAlxN has its maximum. The effect is split into a strain and an interfacial (or chemical) contribution, and we show that both contributions are significant. An analysis of the local atomic structure reveals that the Ti atoms located in the interfacial layers relax significantly different from those in the other atomic layers of the multilayer. Considering the electronic structure of the studied system, we demonstrate that the lower Ti-site projected density of states at epsilon(F) in the Ti1-xAlxN/TiN multilayers compared to the corresponding monolithic bulk explains a decreased tendency toward decomposition.

  • 38.
    Boyd, Robert
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Plasma och beläggningsfysik. Linköpings universitet, Tekniska fakulteten.
    Söderlind, Fredrik
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Kemi. Linköpings universitet, Tekniska fakulteten.
    Helmersson, Ulf
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Plasma och beläggningsfysik. Linköpings universitet, Tekniska fakulteten.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Pilch, Iris
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten.
    Complex 3D nanocoral like structures formed by copper nanoparticle aggregation on nanostructured zinc oxide rods2016Inngår i: Materials letters (General ed.), ISSN 0167-577X, E-ISSN 1873-4979, Vol. 184, s. 127-130Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    This paper reports a new strategy for nanoparticle surface assembly so that they form anisotropic fibril like features, consisting of particles directly attached to each other, which can extend 500 nm from the surface. The particles are both formed and deposited in a single step process enabled via the use of a pulsed plasma based technique. Using this approach, we have successfully modified zinc oxide rods, up to several hundred nanometers in diameter, with 25 nm diameter copper nanoparticles for catalytic applications. The resulting structure could be modelled using a diffusion limited aggregation based approach. This gives the material the appearance of marine coral, hence the term nanocoral. (C) 2016 Elsevier B.V. All rights reserved.

  • 39.
    Yalamanchili, Phani Kumar
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi. Linköpings universitet, Tekniska fakulteten.
    Wang, Fei
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten. University of Saarland, Germany.
    Aboulfadl, Hisham
    University of Saarland, Germany.
    Barrirero, Jenifer
    Linköpings universitet, Institutionen för fysik, kemi och biologi. Linköpings universitet, Tekniska fakulteten. University of Saarland, Germany.
    Rogström, Lina
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Jimenez-Pique, Emilio
    University of Politecn Cataluna, Spain; CRnE UPC, Spain.
    Muecklich, Frank
    University of Saarland, Germany.
    Tasnadi, Ferenc
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Ghafoor, Naureen
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Growth and thermal stability of TiN/ZrAlN: Effect of internal interfaces2016Inngår i: Acta Materialia, ISSN 1359-6454, E-ISSN 1873-2453, Vol. 121, s. 396-406Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    Wear resistant hard films comprised of cubic transition metal nitride (c-TMN) and metastable c-AlN with coherent interfaces have a confined operating envelope governed by the limited thermal stability of metastable phases. However, equilibrium phases (c-TMN and wurtzite(w)-AlN) forming semicoherent interfaces during film growth offer higher thermal stability. We demonstrate this concept for a model multilayer system with TiN and ZrAlN layers where the latter is a nanocomposite of ZrN- and AlN-rich domains. The interfaces between the domains are tuned by changing the AlN crystal structure by varying the multilayer architecture and growth temperature. The interface energy minimization at higher growth temperature leads to formation of semicoherent interfaces between w-AlN and c-TMN during growth of 15 nm thin layers. Ab initio calculations predict higher thermodynamic stability of semicoherent interfaces between c-TMN and w-AlN than isostructural coherent interfaces between c-TMN and c-AlN. The combination of a stable interface structure and confinement of w-AlN to nm-sized domains by its low solubility in c-TMN in a multilayer, results in films with a stable hardness of 34 GPa even after annealing at 1150 degrees C. (C) 2016 Acta Materialia Inc. Published by Elsevier Ltd. All rights reserved.

  • 40.
    Shulumba, Nina
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. University of Saarland, Germany.
    Raza, Zamaan
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten.
    Hellman, Olle
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten. Division of Engineering and Applied Science, California Institute of Technology, Pasadena, California, USA.
    Janzén, Erik
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Halvledarmaterial. Linköpings universitet, Tekniska fakulteten.
    Abrikosov, Igor
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten. Materials Modeling and Development Laboratory, NUST “MISIS”, Moscow, Russia; LACOMAS Laboratory, Tomsk State University, Tomsk, Russia.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Impact of anharmonic effects on the phase stability, thermal transport, and electronic properties of AlN2016Inngår i: Physical Review B, ISSN 2469-9950, E-ISSN 2469-9969, Vol. 94, nr 10, artikkel-id 104305Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    Wurtzite aluminium nitride is a technologically important wide band gap semiconductor with an unusually high thermal conductivity, used in optical applications and as a heatsink substrate. Many of its properties depend on an accurate description of its lattice dynamics, which have thus far only been captured in the quasiharmonic approximation. In this work, we demonstrate that anharmonicity has a considerable impact on its phase stability and transport properties, since anharmonicity is much stronger in the rocksalt phase. We compute a pressure-temperature phase diagram of AlN, demonstrating that the rocksalt phase is stabilised by increasing temperature, with respect to the wurtzite phase. We demonstrate that including anharmonicity, we can recover the thermal conductivity of the wurtzite phase (320 Wm−1K−1 under ambient conditions), and compute the hitherto unknown thermal conductivity of the rocksalt phase (96 Wm−1K−1). We also show that the electronic band gap decreases with temperature. These findings provide further evidence that anharmonic effects cannot be ignored in high temperature applications.

  • 41.
    Schramm, Isabella
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi. Linköpings universitet, Tekniska fakulteten. University of Saarland, Germany.
    Johansson Jöesaar, Mats P.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. SECO Tools AB, Sweden.
    Jensen, Jens
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten.
    Muecklich, F.
    University of Saarland, Germany.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Impact of nitrogen vacancies on the high temperature behavior of (Ti1-xAlx)N-y alloys2016Inngår i: Acta Materialia, ISSN 1359-6454, E-ISSN 1873-2453, Vol. 119, s. 218-228Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    Substoichiometric solid solution alloys of cubic (Ti1-xAlx)N-y with x = 0.26, 0.48 and 0.60, and y ranging from 0.93 to 0.75 were grown by cathodic arc deposition. The influence of nitrogen deficiency on their thermal stability was studied by X-ray diffractometry, differential scanning calorimetry, scanning electron microscopy, and atom probe tomography. The nitrogen deficiency did not significantly affect the columnar growth nor the as deposited hardness. At elevated temperatures, alloys with x = 0.48 and 0.60 decompose isostructurally into cubic c-TiN and cubic c-AlN domains, which is consistent with spinodal decomposition. The decomposition is retarded by decreasing the nitrogen content, e.g. the formed isostructural domains in (Ti0.52Al0.48)N-0.92 at 900 degrees C are similar in size to (Ti0.52Al0.48)N-0.75 at 1200 degrees C. The formation of hexagonal w-AlN is shifted to higher temperatures by decreasing nitrogen content. Nucleation and growth of Al-Ti clusters in a Ti rich matrix were observed for the alloys with high Ti content, x = 0.26. These results suggest that nitrogen deficiency reduces the driving force for phase separation. (C) 2016 Acta Materialia Inc. Published by Elsevier Ltd. All rights reserved.

  • 42.
    Yalamanchili, Phani Kumar
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi. Linköpings universitet, Tekniska fakulteten. Departamento de Ciencia de los Materiales e Ingeniería Metalúrgica, Center for Research in Nanoengineering, CRnE-UPC Avda, Barcelona, Spain.
    Jimenez-Pique, E.
    Departamento de Ciencia de los Materiales e Ingeniería Metalúrgica, Center for Research in Nanoengineering, CRnE-UPC Avda, Barcelona, Spain.
    Pelcastre, L.
    Division of Machine Elements, Luleå University of Technology, Luleå, Sweden.
    Bakoglidis, Konstantinos
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten.
    Roa, J. J.
    Departamento de Ciencia de los Materiales e Ingeniería Metalúrgica, Center for Research in Nanoengineering, CRnE-UPC Avda, Barcelona, Spain.
    Johansson Joesaar, M. P.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. Seco Tools AB, Fagersta, Sweden.
    Prakash, B.
    Division of Machine Elements, Luleå University of Technology, Luleå, Sweden.
    Ghafoor, Naureen
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Influence of microstructure and mechanical properties on the tribological behavior of reactive arc deposited Zr-Si-N coatings at room and high temperature2016Inngår i: Surface & Coatings Technology, ISSN 0257-8972, E-ISSN 1879-3347, Vol. 304, s. 393-400Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    Varying the Si-content in Zr-Si-N coatings from 0.2 to 6.3 at.% causes microstructural changes from columnar to nanocomposite structure and a hardness drop from 37 to 26 GPa. The softer nanocomposite also displays lower fracture resistance. The tribological response of these coatings is investigated under different contact conditions, both at room and elevated temperatures. At room temperature tribooxidation is found to be the dominant wear mechanism, where the nanocomposite coatings display the lowest wear rate of 0.64 x 10(-5) mm(3)/Nm, by forming an oxide diffusion barrier layer consisting of Zr, W, and Si. A transition in the dominant wear mechanism from tribooxidation to microploughing is observed upon increasing the test temperature and contact stress. Here, all coatings exhibit significantly higher coefficient of friction of 1.4 and the hardest coatings with columnar structure display the lowest wear rate of 10.5 x 10(-5) mm(3)/Nm. In a microscopic wear test under the influence of contact-induced dominant elastic stress field, the coatings display wedge formation and pileup due to accumulation of the dislocation-induced plastic deformation. In these tests, the nanocomposite coatings display the lowest wear rate of 0.56 x 10(-10) mm(3)/Nm, by constraining the dislocation motion. (C) 2016 Elsevier B.V. All rights reseved.

  • 43.
    Yang, Jing
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. University of Politecn Cataluna, Spain.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Johansson-Joesaar, Mats P.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. SECO Tools AB, Sweden.
    Llanes, L.
    University of Politecn Cataluna, Spain; University of Politecn Cataluna, Spain.
    Influence of substrate microstructure and surface finish on cracking and delamination response of TiN-coated cemented carbides2016Inngår i: Wear, ISSN 0043-1648, E-ISSN 1873-2577, Vol. 352-353, s. 102-111Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    The cracking and delamination of TiN-coated hardmetals (WC-Co cemented carbides) when subjected to Brale indentation were studied. Experimental variables were substrate microstructure related to low (6 wt% Co) and medium (13 wt% Co) binder content, and surface finishes associated with grinding and polishing stages before film deposition. Brale indentation tests were conducted on both coated and uncoated hardmetals. Emphasis has been placed on assessing substrate microstructure and subsurface finish effects on load levels at which cracking and delamination phenomena emerge, the type of cracking pattern developed, and how fracture mechanisms evolve with increasing load. It is found that polished and coated hardmetals are more brittle (radial cracking) and the adhesion strength (coating delamination) diminishes with decreasing binder content. Such a response is discussed on the basis of the influence of intrinsic hardness/brittleness of the hardmetal substrate on both cracking at the subsurface level and effective stress state, particularly regarding changes in shear stress component. Grinding promotes delamination compared to the polished condition, but strongly inhibits radial cracking. This is a result of the interaction between elastic-plastic deformation imposed during indentation and several grinding-induced effects: remnant compressive stress field, pronounced surface texture and micro cracking within a thin altered subsurface layer. As a consequence, coating spallation prevails over radial cracking as the main mechanism for energy dissipation in ground and coated hardmetals. (C) 2016 Elsevier B.V. All rights reserved.

  • 44.
    Shulumba, Nina
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi. Linköpings universitet, Tekniska fakulteten. University of Saarland, Germany.
    Hellman, Olle
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten. CALTECH, CA 91125 USA.
    Raza, Zamaan
    Linköpings universitet, Institutionen för fysik, kemi och biologi. Linköpings universitet, Tekniska fakulteten.
    Alling, Björn
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten. Max Planck Institute Eisenforsch GmbH, Germany.
    Barrirero, Jenifer
    Linköpings universitet, Institutionen för fysik, kemi och biologi. Linköpings universitet, Tekniska fakulteten. University of Saarland, Germany.
    Muecklich, Frank
    University of Saarland, Germany.
    Abrikosov, Igor
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten. NUST MISIS, Russia.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Lattice Vibrations Change the Solid Solubility of an Alloy at High Temperatures2016Inngår i: Physical Review Letters, ISSN 0031-9007, E-ISSN 1079-7114, Vol. 117, nr 20, artikkel-id 205502Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    We develop a method to accurately and efficiently determine the vibrational free energy as a function of temperature and volume for substitutional alloys from first principles. Taking Ti1-xAlxN alloy as a model system, we calculate the isostructural phase diagram by finding the global minimum of the free energy corresponding to the true equilibrium state of the system. We demonstrate that the vibrational contribution including anharmonicity and temperature dependence of the mixing enthalpy have a decisive impact on the calculated phase diagram of a Ti1-xAlxN alloy, lowering the maximum temperature for the miscibility gap from 6560 to 2860 K. Our local chemical composition measurements on thermally aged Ti0.5Al0.5N alloys agree with the calculated phase diagram.

  • 45.
    Johnson, Lars
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska högskolan.
    Ghafoor, Naureen
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska högskolan.
    Engberg, David
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten.
    Thuvander, Mattias
    Dept. of Applied Physics, Chalmers University of Technology, Göteborg, Sweden.
    Stiller, Krystyna
    Chalmers University of Technology, Microscopy and Microanalysis, Department of Applied Physics, Göteborg, Sweden.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska högskolan.
    Hultman, Lars
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska högskolan.
    Self-organized Nanostructuring in Zr0.64Al0.36N Thin Films Studied by Atom Probe Tomography2016Inngår i: Thin Solid Films, ISSN 0040-6090, E-ISSN 1879-2731, s. 233-238Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    We have applied atom probe tomography (apt) to analyze the selforganized structure of wear-resistant Zr0.64Al0.36N thin films grown by magnetron sputtering. Transmission electron microscopy shows that these films grow as a two-dimensional nanocomposite, consisting of interleaved lamellae in a labyrinthine structure, with a size scale of ∼ 5 nm. The structure was recovered in the Al apt signal, while the Zr and N data lacked structural information due to severe local magnification effects. The onset of the self-organized growth was observed to occur locally by nucleation, at 5-8 nm from the MgO substrate, after increasing Zr-Al compositional fluctuations. Finally, it was observed that the self-organized growth mode could be perturbed by renucleation of ZrN.

  • 46.
    Sen Karaman, D.
    et al.
    Abo Akad University, Finland; Abo Akad University, Finland.
    Sarwar, S.
    Bose Institute, India.
    Desai, D.
    Abo Akad University, Finland.
    Björk, Emma
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Chakrabarti, P.
    Bose Institute, India.
    Rosenholm, J. M.
    Abo Akad University, Finland.
    Chakraborti, S.
    Bose Institute, India; Indiana University, IN USA.
    Shape engineering boosts antibacterial activity of chitosan coated mesoporous silica nanoparticle doped with silver: a mechanistic investigation2016Inngår i: Journal of materials chemistry. B, ISSN 2050-750X, E-ISSN 2050-7518, Vol. 4, nr 19, s. 3292-3304Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    In this study, mesoporous silica nanoparticles (MSPs) of different size and shape were developed, and their surface coatings were utilized to study their differential effects in enhancing antibacterial activity. In brief, MSPs with three different aspect ratios (1, 2 and 4) were prepared, doped with silver ions and finally coated with the polymer chitosan. Both Gram-positive and Gram-negative bacteria were treated with the MSPs. Results indicate that silver ion doped and chitosan coated MSPs with the aspect ratio of 4 (Cht/MSP4:Ag+) have the highest antimicrobial activity among the prepared series. Further studies revealed that Cht/MSP4:Ag+ was most effective against Escherichia coli (E.coli) and least effective against Vibrio cholerae (V. cholerae). To investigate the detailed inhibition mechanism of the MSPs, the interaction of the nanoparticles with E.coli membranes and its intracellular DNA was assessed using various spectroscopic and imaging-based techniques. Furthermore, to increase the efficiency of the MSPs, a combinatorial antibacterial strategy was also explored, where nanoparticles, in combination with kanamycin (antibiotic), were used against Vibrio Cholerae (V. cholerae). Toxicity screening of these on MSPs was conducted on Caco-2 cells, and the results show that the dose used for antibacterial screening is below the limit of the toxicity threshold. Our findings show that both shape and surface engineering contribute positively towards killing bacteria, and the newly developed silver ion-doped and chitosan-coated MSPs have good potential as antimicrobial nanomaterials.

  • 47.
    Yang, Jie
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Biomolekylär och Organisk Elektronik. Linköpings universitet, Tekniska fakulteten. University of Politecn Cataluna, Spain.
    Roa, J. J.
    University of Politecn Cataluna, Spain; University of Politecn Cataluna, Spain.
    Schwind, M.
    SECO Tools AB, Sweden.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Johansson-Jõesaar, Mats P.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. SECO Tools AB, Sweden.
    Esteve, J.
    University of Barcelona, Spain.
    Llanes, L.
    University of Politecn Cataluna, Spain.
    Thermally induced surface integrity changes of ground WC-Co hardmetals2016Inngår i: 3RD CIRP CONFERENCE ON SURFACE INTEGRITY, Elsevier, 2016, Vol. 45, s. 91-94Konferansepaper (Fagfellevurdert)
    Abstract [en]

    Ground hardmetals are exposed to high temperatures during both processing (e.g. coating deposition) and use (e.g. as a cutting tool). However, studies on thermally induced changes of surface integrity are limited. Here we address this by means of FIB/FESEM and EBSD investigation, with special focus on the binder phase characterization. Our findings indicate that thermal treatment causes two main surface modifications. First, an unexpected microporosity appears in the binder within the subsurface layer when ground surfaces are heated. Second, the metallic phase underneath the ground surface experiences metallurgical changes, in terms of grain and crystallographic phase structures. The mechanisms responsible for these modifications of the binder are discussed in terms of grinding-induced and thermally-reversed phase transformation as well as recrystallization phenomena. We also note that no additional heat treatment related changes such as microcracking and carbide fragmentation in the subsurface layer, are discerned. (C) 2016 The Authors. Published by Elsevier B.V.

  • 48.
    Shulumba, Nina
    et al.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. University of Saarland, Germany.
    Hellman, Olle
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten. Division of Engineering and Applied Science, California Institute of Technology, Pasadena, California, USA.
    Raza, Zamaan
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten.
    Alling, Björn
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten. Max-Planck-Institut für Eisenforschung GmbH, Düsseldorf, Germany.
    Barrirero, Jennifer
    Linköpings universitet, Institutionen för fysik, kemi och biologi. Linköpings universitet, Tekniska fakulteten. Functional Materials, Saarland University, Campus D3 3, Saarbrücken, Germany.
    Mücklich, Frank
    Functional Materials, Saarland University, Campus D3 3, Saarbrücken, Germany.
    Abrikosov, Igor
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Teoretisk Fysik. Linköpings universitet, Tekniska fakulteten. Materials Modeling and Development Laboratory, NUST “MISIS”, Moscow, Russia / LACOMAS Laboratory, Tomsk State University, Tomsk, Russia.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Anharmonicity changes the solid solubility of an alloy at high temperatures2015Manuskript (preprint) (Annet vitenskapelig)
    Abstract [en]

    We have developed a method to accurately and efficiently determine the vibrational free energy as a function of temperature and volume for substitutional alloys from first principles. Taking Ti1−xAlxN alloy as a model system, we calculate the isostructural phase diagram by finding the global minimum of the free energy, corresponding to the true equilibrium state of the system. We demonstrate that the anharmonic contribution and temperature dependence of the mixing enthalpy have a decisive impact on the calculated phase diagram of a Ti1−xAlxN alloy, lowering the maximum temperature for the miscibility gap from 6560 K to 2860 K. Our local chemical composition measurements on thermally aged Ti0.5Al0.5N alloys agree with the calculated phase diagram.

  • 49.
    Yang, Jing
    et al.
    University of Politecn Cataluna, Spain.
    Garcia Marro, F.
    University of Politecn Cataluna, Spain; University of Politecn Cataluna, Spain.
    Trifonov, T.
    University of Politecn Cataluna, Spain.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Johansson-Jöesaar, Mats P.
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten. SECO Tools AB, Sweden.
    Llanes, L.
    University of Politecn Cataluna, Spain; University of Politecn Cataluna, Spain.
    Contact damage resistance of TiN-coated hardmetals: Beneficial effects associated with substrate grinding2015Inngår i: Surface & Coatings Technology, ISSN 0257-8972, E-ISSN 1879-3347, Vol. 275, s. 133-141Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    Contact loading is a common service condition for coated hardmetal tools and components. Substrate grinding represents a key step within the manufacturing chain of these coated systems. Within this context, the influence of surface integrity changes caused by abrasive grinding of the hardmetal substrate, prior to coating, is evaluated with respect to contact damage resistance. Three different substrate surface finish conditions are studied: ground (G), mirror-like polished (P) and ground plus heat-treated (GTT). Tests are conducted by means of spherical indentation under increasing monotonic load and the contact damage resistance is assessed. Substrate grinding enhances resistance against both crack nucleation at the coating surface and subsequent propagation into the hardmetal substrate. Hence, crack emergence and damage evolution is effectively delayed for the coated G condition, as compared to the reference P one. The observed system response is discussed on the basis of the beneficial effects associated with compressive residual stresses remnant at the subsurface level after grinding, ion-etching and coating. The influence of the stress state is further corroborated by the lower contact damage resistance exhibited by the coated GTT specimens. Finally, differences observed on the interaction between indentation-induced damage and failure mode under flexural testing points in the direction that substrate grinding also enhances damage tolerance of the coated system when exposed to contact loads.

  • 50.
    Schroeder, Jeremy
    et al.
    Linköpings universitet, Tekniska fakulteten. Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik.
    Thomson, W.
    PVD Prod Inc, MA 01887 USA.
    Howard, B.
    PVD Prod Inc, MA 01887 USA.
    Schell, N.
    Helmholtz Zentrum Geesthacht, Germany.
    Näslund, Lars-Åke
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten.
    Rogström, Lina
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Johansson-Jöesaar, Mats P.
    Seco Tools AB, Sweden.
    Ghafoor, Naureen
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Odén, Magnus
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Nanostrukturerade material. Linköpings universitet, Tekniska fakulteten.
    Nothnagel, E.
    PVD Prod Inc, MA 01887 USA.
    Shepard, A.
    PVD Prod Inc, MA 01887 USA.
    Greer, J.
    PVD Prod Inc, MA 01887 USA.
    Birch, Jens
    Linköpings universitet, Institutionen för fysik, kemi och biologi, Tunnfilmsfysik. Linköpings universitet, Tekniska fakulteten.
    Industry-relevant magnetron sputtering and cathodic arc ultra-high vacuum deposition system for in situ x-ray diffraction studies of thin film growth using high energy synchrotron radiation2015Inngår i: Review of Scientific Instruments, ISSN 0034-6748, E-ISSN 1089-7623, Vol. 86, nr 9, s. 095113-Artikkel i tidsskrift (Fagfellevurdert)
    Abstract [en]

    We present an industry-relevant, large-scale, ultra-high vacuum (UHV) magnetron sputtering and cathodic arc deposition system purposefully designed for time-resolved in situ thin film deposition/annealing studies using high-energy (greater than50 keV), high photon flux (greater than10(12) ph/s) synchrotron radiation. The high photon flux, combined with a fast-acquisition-time (less than1 s) two-dimensional (2D) detector, permits time-resolved in situ structural analysis of thin film formation processes. The high-energy synchrotron-radiation based x-rays result in small scattering angles (less than11 degrees), allowing large areas of reciprocal space to be imaged with a 2D detector. The system has been designed for use on the 1-tonne, ultra-high load, high-resolution hexapod at the P07 High Energy Materials Science beamline at PETRA III at the Deutsches Elektronen-Synchrotron in Hamburg, Germany. The deposition system includes standard features of a typical UHV deposition system plus a range of special features suited for synchrotron radiation studies and industry-relevant processes. We openly encourage the materials research community to contact us for collaborative opportunities using this unique and versatile scientific instrument. (C) 2015 AIP Publishing LLC.

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