David Holec

101 - 200 out of 280Page size: 100

Research output

  1. 2018
  2. E-pub ahead of print

    Origin of the Low Magnetic Moment in Fe₂AlTi: An Ab Initio Study

    Friák, M., Slávik, A., Miháliková, I., Holec, D., Všianská, M., Šob, M., Palm, M. & Neugebauer, J., 14 Sept 2018, (E-pub ahead of print) In: Materials. 11.2018, 9, 10 p., 1732.

    Research output: Contribution to journal › Article › Research › peer-review

  3. Published

    An ab initio study of thermodynamic and mechanical stability of heusler-based Fe2AlCo polymorphs

    Friák, M., Oweisová, S., Pavlu, J., Holec, D. & Šob, M., 27 Aug 2018, In: Materials. 11.2018, 9, 12 p., 1543.

    Research output: Contribution to journal › Article › Research › peer-review

  4. E-pub ahead of print

    Theory-guided metal-decoration of nanoporous carbon for hydrogen storage applications

    Holec, D., Kostoglou, N., Tampaxis, C., Babic, B., Mitterer, C. & Rebholz, C., 26 Jul 2018, (E-pub ahead of print) In: Surface & coatings technology. 351.2018, 15 October, p. 42-49 8 p.

    Research output: Contribution to journal › Article › Research › peer-review

  5. Published

    Ab initio inspired design of ternary boride thin films

    Moraes, V., Riedl, H., Fuger, C., Polcik, P., Bolvardi, H., Holec, D. & Mayrhofer, P. H., 18 Jun 2018, In: Scientific reports (London : Nature Publishing Group). 8.2018, p. 1-9 9 p., 9288.

    Research output: Contribution to journal › Article › Research › peer-review

  6. Published

    Graphite under compression: shift of layer breathing and shear modes frequencies with interlayer spacing

    Sun, Y. W., Holec, D., Xu, Y. & Dunstan, D. J., 3 Apr 2018, In: Journal of Physics Communications. 2018, 2, p. 2-7 6 p., 045004.

    Research output: Contribution to journal › Article › Research › peer-review

  7. Published

    Influence of carbon deficiency on phase formation and thermal stability of super-hard TaCy thin films

    Riedl, H., Glechner, T., Wojcik, T., Koutná, N., Kolozsvári, S., Paneta, V., Holec, D., Primetzhofer, D. & Mayrhofer, P. H., 9 Mar 2018, In: Scripta materialia. 149.2018, May, p. 150-154 5 p.

    Research output: Contribution to journal › Article › Research › peer-review

  8. E-pub ahead of print

    Pathways of phase transformation in β-phase-stabilized σ/γ-TiAl alloys subjected to two-step heat treatments

    Klein, T., Holec, D., Clemens, H. & Mayer, S., 9 Mar 2018, (E-pub ahead of print) In: Scripta materialia. 149.2018, May, p. 70-74 5 p.

    Research output: Contribution to journal › Article › Research › peer-review

  9. Published

    An ab initio study of mechanical and dynamical stability of MoSi2

    Friák, M., Holec, D. & Šob, M., 19 Feb 2018, In: Journal of alloys and compounds. 746.2018, 25 May, p. 720-728 9 p.

    Research output: Contribution to journal › Article › Research › peer-review

  10. Published

    Stability and elasticity of metastable solid solutiions and superlattices in the MoN-TaN system: First-principles calculations

    Koutná, N., Holec, D., Friák, M., Mayrhofer, P. H. & Šob, M., 14 Feb 2018, In: Materials and Design. 144.2018, April, p. 310-322 13 p.

    Research output: Contribution to journal › Article › Research › peer-review

  11. Published

    Combined theoretical and experimental study of Fe-Al-Ti superalloys

    Friák, M., Miháliková, I., Slávik, A., Homola, V., Bursikova, V., Pizurová, N., Pavlu, J., Dymacek, P., Dobes, F., Holec, D., Koutná, N., Jiraskova, Y. & Šob, M., 2018.

    Research output: Contribution to conference › Poster › Research

  12. Published

    Elasticity of interfaces: a multi-method approach

    Holec, D., Koutná, N., Vsianská, M., Friák, M., Mayrhofer, P. H. & Šob, M., 2018.

    Research output: Contribution to conference › Poster › Research

  13. Published

    Mechanical properties of CrN/TiN supperlattices from ab inito calculations

    Löfler, L., Bartosik, M., Mayrhofer, P. H. & Holec, D., 2018.

    Research output: Contribution to conference › Poster › Research

  14. Published

    Multi method study of the stabilization of alumina on Al-Cr droplets

    Löfler, L., Holec, D. & Mayrhofer, P. H., 2018.

    Research output: Contribution to conference › Poster › Research

  15. Published

    Multi-Scale Microstructural Characterization: The Role of Classic and High-Resolution Metallography in the Developement of Modern High-Performance Materials

    Schnitzer, R., Hofer, C., Mayer, S., Panzenböck, M., Holec, D. & Clemens, H., 2018, In: Practical metallography = Praktische Metallographie. 55.2018, 9, p. 584-602 19 p.

    Research output: Contribution to journal › Article › Research › peer-review

  16. Published

    Ordering and diffusionless transformations in TiAl

    Abdoshahi, N. & Holec, D., 2018.

    Research output: Contribution to conference › Poster › Research

  17. Published

    Skalenübergreifende Gefügechatakterisierung - Die Rolle der klassischen und hochauflösenden Metallographie bei der Entwicklung moderner Hochleistungswerkstoffe

    Schnitzer, R., Hofer, C., Mayer, S., Panzenböck, M., Holec, D. & Clemens, H., 2018, Praktische Metallographie Sonderband: Fortschritte in der Metallographie. 1 ed. Vol. 52. p. 23-34

    Research output: Chapter in Book/Report/Conference proceeding › Conference contribution

  18. Published

    Surface energy of nanoparticles - influence of particle size and structures

    Vollath, D., Fischer, F.-D. & Holec, D., 2018, In: Beilstein journal of nanotechnology (Online-Ressource). 2018, 9, p. 2265-2276 12 p.

    Research output: Contribution to journal › Article › Research › peer-review

  19. 2017
  20. Published

    Impact of Alloying on Stacking Fault Energies in γ-TiAl

    Dumitraschkewitz, P., Clemens, H., Mayer, S. & Holec, D., 17 Nov 2017, In: Applied Sciences : open access journal. 7.2017, 11, 11 p., 1193.

    Research output: Contribution to journal › Article › Research › peer-review

  21. Published

    Au55, a stable glassy cluster: results of ab initio calculations

    Vollath, D., Holec, D. & Fischer, F.-D., 25 Oct 2017, In: Beilstein journal of nanotechnology . 8.2017, p. 2221-2229 9 p.

    Research output: Contribution to journal › Article › Research › peer-review

  22. E-pub ahead of print

    Interface-induced electronic structure toughening of nitride superlatices

    Rehák, P., Cerny, M. & Holec, D., 25 Sept 2017, (E-pub ahead of print) In: Surface & coatings technology. 325.2017, September, p. 410-416 7 p.

    Research output: Contribution to journal › Article › Research › peer-review

  23. E-pub ahead of print

    On grain boundary segregation in molybdenum materials

    Leitner, K., Felfer, P. J., Holec, D., Cairney, J. M., Knabl, W., Lorich, A., Clemens, H. & Primig, S., 11 Sept 2017, (E-pub ahead of print) In: Materials and Design. 135.2017, 5 December, p. 204-212 9 p.

    Research output: Contribution to journal › Article › Research › peer-review

  24. Published

    Magnetic properties of the CrMnFeCoNi high-entropy alloy

    Schneeweiss, O., Friák, M., Dudová, M., Holec, D., Šob, M., Kriegner, D., Holy, V., Beran, P., George, E. P., Neugebauer, J. & Dlouhy, A., 28 Jul 2017, In: Physical review : B, Condensed matter and materials physics. 96.2017, 15 May, 13 p., 014437.

    Research output: Contribution to journal › Article › Research › peer-review

  25. Published

    Optical properties of TixSi1−xO2 solid solutions

    Ondračka, P., Holec, D., Nečas, D., Kedroňová, E., Elisabeth, S., Goullet, A. & Zajickkova, L., 30 May 2017, In: Physical review : B, Condensed matter and materials physics. 95.2017, 19, 10 p., 195163.

    Research output: Contribution to journal › Article › Research › peer-review

  26. E-pub ahead of print

    Thermal stability and oxidation resistance of sputtered Ti-Al-Cr-N hard coatings

    Xu, Y. X., Riedl, H., Holec, D., Chen, L., Du, Y. & Mayrhofer, P. H., 20 May 2017, (E-pub ahead of print) In: Surface & coatings technology. 324.2017, 15 September, p. 48-56 9 p.

    Research output: Contribution to journal › Article › Research › peer-review

  27. Published

    Tensorial elastic properties and stability of interface states associated with 5(210) grain boundaries in (Al,Si)

    Friák, M., Všianská, M., Holec, D., Zelený, M. & Šob, M., 2 May 2017, In: Science and Technology of Advanced Materials. 18.2017, 1, p. 273-282 10 p.

    Research output: Contribution to journal › Article › Research › peer-review

  28. E-pub ahead of print

    Structure and surface energy of Au55 nanoparticles: An ab initio study

    Holec, D., Fischer, F.-D. & Vollath, D., 6 Apr 2017, (E-pub ahead of print) In: Computational materials science. 134.2017, 15 June, p. 137-144 8 p.

    Research output: Contribution to journal › Article › Research › peer-review

  29. E-pub ahead of print

    Peculiarity of self-assembled cubic nanolamellae in the TiN/AlN system: Epitaxial self-stabilization by element deficiency/excess

    Zalesak, J., Holec, D., Matko, I., Petrenec, M., Sartory, B., Koutna, N., Daniel, R., Pitonak, R. & Keckes, J., 5 Apr 2017, (E-pub ahead of print) In: Acta materialia. 131.2017, 1 June, p. 391-399 9 p.

    Research output: Contribution to journal › Article › Research › peer-review

  30. Published

    Superlattice-induced oscillations of interplanar distances and strain effects in the CrN/AlN system

    Zhang, Z., Gu, X., Holec, D., Bartosik, M., Mayrhofer, P. H. & Duan, H., 5 Apr 2017, In: Physical review : B, Condensed matter and materials physics. 95.2017, 15, 7 p., 155305.

    Research output: Contribution to journal › Article › Research › peer-review

  31. E-pub ahead of print

    Intermetallic β-Solidifying γ-TiAl Based Alloys − From Fundamental Research to Application

    Mayer, S., Erdely, P., Fischer, F.-D., Holec, D., Kastenhuber, M., Klein, T. & Clemens, H., 23 Feb 2017, (E-pub ahead of print) In: Advanced engineering materials. 19.2017, 4, 27 p., 1600735.

    Research output: Contribution to journal › Article › Research › peer-review

  32. E-pub ahead of print

    Impact of Mo on the ωo phase in β-solidifying TiAl alloys: An experimental and computational approach

    Klein, T., Schachermayer, M., Holec, D., Rashkova, B., Clemens, H. & Mayer, S., 1 Feb 2017, (E-pub ahead of print) In: Intermetallics. 85.2017, June, p. 26-33 8 p.

    Research output: Contribution to journal › Article › Research › peer-review

  33. Published

    Atomistic modelling-based design of novel materials

    Holec, D., Zhou, L., Riedl, H., Koller, C., Mayrhofer, P. H., Friák, M., Šob, M., Körmann, F., Neugebauer, J., Music, D., Hartmann, M. A. & Fischer, F.-D., 17 Jan 2017, In: Advanced engineering materials. 19.2017, 4, 19 p., 1600688.

    Research output: Contribution to journal › Article › Research › peer-review

  34. Published

    Systematic ab initio investigation of the elastic modulus in quaternary transition metal nitride alloys and their coherent multilayers

    Wang, F., Holec, D., Odén, M., Mücklich, F., Abrikosov, I. A. & Tasnádi, F., 10 Jan 2017, In: Acta materialia. 127.2017, 1 April, p. 124-132 9 p.

    Research output: Contribution to journal › Article › Research › peer-review

  35. Published

    First Principles Study of Water-Based Self-Assembled Nanobearing Effect in CrN/TiN Multilayer Coatings

    Holec, D., Paulitsch, J. & Mayrhofer, P. H., 2017, Solid State Phenomena. 258 ed. p. 373-378 6 p. (Solid State Phenomena).

    Research output: Chapter in Book/Report/Conference proceeding › Chapter › Research

  36. Published

    Mechaniical and structural properties of CrN/AlN superlattices

    Holec, D., Friák, M., Bartosik, M. & Mayrhofer, P. H., 2017.

    Research output: Contribution to conference › Poster › Research › peer-review

  37. Published

    Non-reactively sputtered ultra-high temperature Hf-C and Ta-C coatings

    Lasfargues, H., Glechner, T., Koller, C., Paneta, V., Primetzhofer, D., Kolozsvari, S., Holec, D., Riedl, H. & Mayrhofer, P. H., 2017, In: Surface & coatings technology. 309.2017, 15 January, p. 436-444 9 p.

    Research output: Contribution to journal › Article › Research › peer-review

  38. Published

    Optimised structural models of solid slotions for tensorial properties

    Nöger, D. & Holec, D., 2017.

    Research output: Contribution to conference › Poster › Research

  39. Published

    Quantum-mechanical study of tensorial elastic and high-temperature thermodynamic properties of grain boundary states in superalloy-phase Ni3Al

    Friák, M., Vsianska, M., Holec, D. & Šob, M., 2017, In: IOP Conference Series: Materials Science and Engineering. 219.2017, 11 p., 012019.

    Research output: Contribution to journal › Article › Research › peer-review

  40. Published

    Thermal expansion of Ti-Al-N and Cr-Al-N coatings

    Bartosik, M., Holec, D., Apel, D., Klaus, M., Genzel, C., Keckes, J., Arndt, M., Polcik, P., Koller, C. M. & Mayrhofer, P. H., 2017, In: Scripta materialia. 127.2017, 15 January, p. 182-185 4 p.

    Research output: Contribution to journal › Article › Research › peer-review

  41. Published

    Vacancy-driven extended stability of cubic metastable Ta-Al-N and Nb-Al-N phases

    Pacher, F., Mayrhofer, P. H. & Holec, D., 2017, In: Surface & coatings technology. 326.2017, 15 October, Part A, p. 37-44 8 p.

    Research output: Contribution to journal › Article › Research › peer-review

  42. 2016
  43. Published

    Atomistic pieces of the Materials Design jigsaw puzzle: From Schrödinger equation to thermal expansion

    Holec, D., 1 Nov 2016.

    Research output: Contribution to conference › Presentation › Research

  44. Published

    Application of first principles methods in developments of novel intermetallic alloys

    Holec, D., 29 Aug 2016.

    Research output: Contribution to conference › Presentation › Research

  45. Published

    Influence of varying nitrogen partial pressures on microstructure, mechanical and optical properties of sputtered TiAlON coatings

    Schalk, N., Simonet Fotso, J., Holec, D., Fian, A., Jakopic, G., Terziyska, V., Daniel, R. & Mitterer, C., 27 Apr 2016.

    Research output: Contribution to conference › Presentation › Research

  46. Published

    Size-dependent surface energies of Au nanoparticles

    Holec, D., Dumitraschkewitz, P., Fischer, F. D. & Vollath, D., 11 Apr 2016, p. 1-13. 13 p.

    Research output: Contribution to conference › Presentation › Research

  47. Published

    Accurate prediction of band gaps and optical properties of HfO2

    Ondracka, P., Holec, D., Necas, D. & Zajickkova, L., 2016, In: Journal of physics / D, Applied physics. 49, p. 395301-1 - 395301-8 8 p.

    Research output: Contribution to journal › Article › Research

  48. Published

    Anisotropic elastic properties and mechanical stability of S5(210) grain-boundary complexions in Ni3Al from ab initio calculations

    Friak, M., Vsianska, M., Holec, D. & Sob, M., 2016.

    Research output: Contribution to conference › Presentation › Research

  49. Published

    Combined experimental and theoretical study of facet-controlled phase separation in supersaturated Au-Ni nanoparticles upon shape equilibration

    Herz, A., Friak, M., Rossberg, D., Hentschel, M., Theska, F., Wang, D., Holec, D., Sob, M., Schneeweiss, O. & Schaaf, P., 2016.

    Research output: Contribution to conference › Presentation › Research

  50. Published

    Compositional trends in grain-boundary elasticity from ab initio calculations: case study of Σ5(210) Ni3(Al,Si)

    Friak, M., Vsianska, M., Holec, D., Zeleny, M. & Sob, M., 2016.

    Research output: Contribution to conference › Poster › Research

  51. Published

    Controlling microstructure, preferred orientation, and mechanical properties of Cr-Al-N by bombardment and alloying with Ta

    Hollerweger, R., Zhou, L., Holec, D., Koller, C., Rachbauer, R., Polcik, P. & Mayrhofer, P. H., 2016, In: Journal of applied physics. 119, p. 1-8 8 p., 119.

    Research output: Contribution to journal › Article › Research

  52. Published

    First principles studies on the impact of point defects on the phase stability of (AlxCr1−x)2O3 solid solutions

    Koller, C., Koutna, N., Ramm, J., Kolozsvari, S., Paulitsch, J., Holec, D. & Mayrhofer, P. H., 2016, In: AIP Advances. 6, p. 025002-2 - 025002-9 9 p.

    Research output: Contribution to journal › Article › Research › peer-review

  53. Published

    Influence of varying nitrogen partial pressures on microstructure, mechanical and optical properties of sputtered TiAlON coatings

    Schalk, N., Simonet Fotso, J., Holec, D., Jakopic, G., Fian, A., Terziyska, V., Daniel, R. & Mitterer, C., 2016, In: Acta materialia. 119, p. 26-34 9 p.

    Research output: Contribution to journal › Article › Research › peer-review

  54. Published

    Interface induced electronic structure toughening of nitride bilayers and superlattices

    Holec, D., Rehák, P. & Cerny, M., 2016.

    Research output: Contribution to conference › Presentation › Research

  55. Published

    Microstructure, mechanical and optical properties of TiAlON coatings sputter-deposited with varying oxygen partial pressures

    Schalk, N., Simonet Fotso, J., Holec, D., Fian, A., Jakopic, G., Terziyska, V., Daniel, R. & Mitterer, C., 2016, In: Journal of physics / D, Applied physics. 49, p. 1-9 9 p.

    Research output: Contribution to journal › Article › Research › peer-review

  56. Published

    Multi-descriptive scale-bridging modelingof hierarchical bio-composites

    Friak, M., Pfanner, G., Fikar, J., Petrov, M., Nikolov, S., Holec, D., Fabritius, H.-O., Raabe, D., Sob, M., Ziegler, A. & Neugebauer, J., 2016.

    Research output: Contribution to conference › Presentation › Research

  57. Published

    Multiscale approach for predicting mechanical properties of interfaces

    Holec, D., Friak, M., Vsianska, M., Tytko, D., Raabe, D., Sob, M., Neugebauer, H. & Neugebauer, J., 2016.

    Research output: Contribution to conference › Presentation › Research

  58. Published

    On the chemistry of the carbides in a molydbenum base Mo-Hf-C alloy produced by powder metallurgy

    Lang, D., Pöhl, C., Holec, D., Schatte, J., Povoden-Karadeniz, E., Knabl, W., Clemens, H. & Primig, S., 2016, In: Journal of alloys and compounds. 654, p. 445-454

    Research output: Contribution to journal › Article › Research › peer-review

  59. Published

    Point defects stabilise cubic Mo-N and Ta-N

    Koutna, N., Holec, D., Svoboda, O., Klimashin, F. & Mayrhofer, P. H., 2016.

    Research output: Contribution to conference › Poster › Research

  60. Published

    Point defects stabilise cubic Mo-N and Ta-N

    Koutna, N., Holec, D., Svoboda, O., Klimashin, F. & Mayrhofer, P. H., 2016, In: Journal of physics / D, Applied physics. p. 375303-1 - 375303-8 8 p.

    Research output: Contribution to journal › Article › Research

  61. Published

    Predicting an alloying strategy for improving fracture toughness of C15 NbCr2 Laves phase: A first-principles study

    Long, Q., Wang, J., Du, Y., Holec, D., Nie, X. & Jin, Z., 2016, In: Computational materials science. 123, p. 59-64 6 p.

    Research output: Contribution to journal › Article › Research › peer-review

  62. Published

    Preferential site occupancy of alloying elements in TiAl-based phases

    Holec, D., Reddy, R. K., Klein, T. & Clemens, H., 2016, In: Journal of applied physics. 119, p. 1-6 6 p.

    Research output: Contribution to journal › Article › Research › peer-review

  63. Published

    Silicon distribution and silicide precipitation during annealing in an advanced multi-phase g-TiAl based alloy

    Klein, T., Rashkova, B., Holec, D., Clemens, H. & Mayer, S., 2016, In: Acta materialia. 110, p. 236-245 10 p.

    Research output: Contribution to journal › Article › Research › peer-review

  64. Published

    Silicon distribution and silicide precipitation in an advanced multi-phase γ-TiAl based alloy during annealing

    Klein, T., Rashkova, B., Holec, D., Clemens, H. & Mayer, S., 2016.

    Research output: Contribution to conference › Presentation › Research

  65. Published

    Structural and mechanical properties of nitrogen-deficient cubic Cr–Mo–N and Cr–W–N systems

    Zhou, L., Klimashin, F., Holec, D. & Mayrhofer, P. H., 2016, In: Scripta materialia. 123, p. 34-37 4 p.

    Research output: Contribution to journal › Article › Research › peer-review

  66. Published

    Surface adsorption phenomena from first principles

    Holec, D., 2016.

    Research output: Contribution to conference › Presentation › Research

  67. Published

    Tensorialelastic properties and mechanical stability of S5(210) grain-boundary complexions in Ni3Al from ab initiocalculations

    Friak, M., Vsianska, M., Holec, D. & Sob, M., 2016.

    Research output: Contribution to conference › Presentation › Research

  68. Published

    Theory-guided materials design based on ab initio calculations

    Friak, M., Holec, D., Sob, M., Raabe, D. & Neugebauer, J., 2016.

    Research output: Contribution to conference › Presentation › Research

  69. 2015
  70. Published

    Ab initio study on stacking faults in gamma-TiAl

    Dumitraschkewitz, P., Clemens, H., Mayer, S. & Holec, D., 2 Oct 2015.

    Research output: Contribution to conference › Poster › Research

  71. Published

    Ab initio studies on the adsorption and implantation of Al and Fe to nitride materials

    Riedl, H., Zalesak, J., Arndt, M., Polcik, P., Holec, D. & Mayrhofer, P. H., 25 Sept 2015, In: Journal of applied physics. 118.2015, 12, p. 125306 8 p.

    Research output: Contribution to journal › Article › Research › peer-review

  72. Published

    Interplay between effect of Mo and chemical disorder on the stability of β/βo-TiAl phase

    Holec, D., Legut, D., Isaeva, L., Souvatzis, P., Clemens, H. & Mayer, S., 1 Jan 2015, In: Intermetallics. 61, p. 85-90 6 p., 5631.

    Research output: Contribution to journal › Article › Research › peer-review

  73. Published

    Addressing phase stabiltiy of physical vapour deposited (Al,Cr,X)2O3 coatings by density functional theory

    Koller, C., Holec, D., Ramm, J., Kolozsvari, S. & Mayrhofer, P., 2015.

    Research output: Contribution to conference › Presentation › Research › peer-review

  74. Published

    Designing the structure and mechanical properties of TaN

    Mayrhofer, P. H., Marihart, H., Koller, C. & Holec, D., 2015.

    Research output: Contribution to conference › Presentation › Research

  75. Published

    Evaluation of dislocation energy in thin films

    Coppeta, R. A., Holec, D., Ceric, H. & Grasser, T., 2015, In: Philosophical magazine. 95, p. 186-209

    Research output: Contribution to journal › Article › Research › peer-review

  76. Published

    Facet-controlled phase separation in supersaturated Au-Ni nanoparticles upon shape equilibration

    Herz, A., Friak, M., Rossberg, D., Hentschel, M., Theska, F., Wang, D., Holec, D., Sob, M., Schneeweiss, O. & Schaaf, P., 2015, In: Applied physics letters. 107, p. 073109-1 - 073109-5

    Research output: Contribution to journal › Article › Research › peer-review

  77. Published

    First principles modelling of alloying trends

    Holec, D., 2015

    Research output: Thesis › Habilitation thesis › peer-review

  78. Published

    Graphite under uniaxial compression along the c axis: A parameter to relate out-of-plane strain to in-plane phonon frequency

    Sun, Y. W., Holec, D. & Dunstan, D. J., 2015, In: Physical review : B, Condensed matter and materials physics. 92, p. 094108-1-094108-8

    Research output: Contribution to journal › Article › Research › peer-review

  79. Published

    Impact of Al on structure and mechanical properties of TaN and NbN: An experimental and Ab initio study

    Mayrhofer, P., Marihart, H., Koller, C. & Holec, D., 2015.

    Research output: Contribution to conference › Presentation › Research › peer-review

  80. Published

    Interface induced electronic structure toughening of nitride bilayers and superlattices: An ab initio study

    Rehák, P. & Holec, D., 2015.

    Research output: Contribution to conference › Presentation › Research › peer-review

  81. Published

    Microstructure, mechanical and optical properties of TiAlON coatings sputter deposited with varying oxygen partial pressures

    Schalk, N., Simonet Fotso, J., Holec, D., Fian, A., Jakopic, G., Terziyska, V., Daniel, R. & Mitterer, C., 2015.

    Research output: Contribution to conference › Presentation › Research › peer-review

  82. Published

    Microstructure, mechanical and optical properties of TiAlON coatings sputter-deposited with varying oxygen partial pressures

    Schalk, N., Simonet Fotso, J. F. T., Holec, D., Fian, A., Jakopic, G., Terziyska, V. L., Daniel, R. & Mitterer, C., 2015, In: Journal of physics / D, Applied physics.

    Research output: Contribution to journal › Article › Research › peer-review

  83. Published

    Nitrogen atom shift and the structural change in chromium nitride

    Wan, P., Zhang, Z., Holec, D., Daniel, R., Mitterer, C. & Duan, H., 2015, In: Acta materialia. 98, p. 119-127

    Research output: Contribution to journal › Article › Research › peer-review

  84. Published

    On the chemistry of the carbides in a molybdenum base Mo-Hf-C alloy produced by powder metallurgy

    Lang, D., Pöhl, C., Holec, D., Schatte, J., Povoden-Karadeniz, E., Knabl, W., Primig, S. & Clemens, H., 2015.

    Research output: Contribution to conference › Poster › Research

  85. Published

    Origin of temperature-induced low friction of sputtered Si-containing amorphous carbon coatings

    Jantschner, O., Field, S. K., Holec, D., Fian, A., Music, D., Schneider, J. M., Zorn, K. & Mitterer, C., 2015, In: Acta materialia. 82, p. 437-446

    Research output: Contribution to journal › Article › Research › peer-review

  86. Published

    Stacking fault energies and the generalized stacking fault energy of γ-TiAl (ongoing Masterthesis)

    Dumitraschkewitz, P., Clemens, H., Mayer, S. & Holec, D., 2015.

    Research output: Contribution to conference › Presentation › Research › peer-review

  87. Published

    Structural and mechanical properties of nitrogen-deficient cubic Cr-Mo-N and Cr-W-N systems

    Zhou, L., Klimashin, F., Holec, D. & Mayrhofer, P., 2015.

    Research output: Contribution to conference › Presentation › Research › peer-review

  88. Published

    Supersaturated intermetallic phases within the ternary Mo-Cr-N system

    Klimashin, F., Euchner, H., Holec, D. & Mayrhofer, P., 2015.

    Research output: Contribution to conference › Presentation › Research

  89. Published

    Synergy of atom-probe structural data and quantum-mechanical calculations in a theory-guided design of extreme-stiffness superlattices containing metastable phases

    Friak, M., Tytko, D., Holec, D., Choi, P. P., Eisenlohr, P., Raabe, D. & Neugebauer, J., 2015, In: New journal of physics. 17, p. 093004-1-093004-8

    Research output: Contribution to journal › Article › Research › peer-review

  90. Published

    Theory-guided design of high-performance superlatticescontaining metastable phases exemplified by nano-scale CrN/AlN

    Friak, M., Tytko, D., Holec, D., Choi, P. P., Eisenlohr, P., Raabe, D. & Neugebauer, J., 2015.

    Research output: Contribution to conference › Presentation › Research › peer-review

  91. Published

    Theory-guided design of high-strength superlattices containing metastable phases: example of nano-scale CrN/AlN

    Friak, M., Tytko, D., Holec, D., Choi, P. P., Eisenlohr, P., Raabe, D. & Neugebauer, J., 2015.

    Research output: Contribution to conference › Presentation › Research › peer-review

  92. Published

    Theory-guided materials design of high-performance superlattices containing metastable phases: example of nano-scale CrN/AlN

    Friák, M., Tytko, D., Holec, D., Choi, P. P., Eisenlohr, P., Raabe, D. & Neugebauer, J., 2015.

    Research output: Contribution to conference › Presentation › Research › peer-review

  93. Published

    Thermal expansion of rock-salt cubic AlN

    Bartosik, M., Todt, M., Holec, D., Todt, J., Zhou, L., Riedl, H., Böhm, H. J., Rammerstorfer, F. G. & Mayerhofer, P. H., 2015, In: Applied physics letters. 107, p. 071602-1 - 071602-5

    Research output: Contribution to journal › Article › Research › peer-review

  94. Published

    The use of atom probe tomography for the characterization and development of intermetallic γ-TiAl based alloys

    Klein, T., Schachermayer, M., Mendez Martin, F., Holec, D., Rashkova, B., Schöberl, T., Clemens, H. & Mayer, S., 2015.

    Research output: Contribution to conference › Presentation › Research › peer-review

  95. 2014
  96. E-pub ahead of print

    Complementary ab initio and X-ray nanodiffraction studies of Ta2 O5

    Hollerweger, R., Holec, D., Paulitsch, J., Bartosik, M., Daniel, R., Rachbauer, R., Polcik, P., Keckes, J., Krywka, C., Euchner, H. & Mayerhofer, P. H., 30 Oct 2014, (E-pub ahead of print) In: Acta materialia. 83.2015, 15 January, p. 276-284 9 p.

    Research output: Contribution to journal › Article › Research › peer-review

  97. Published

    Ab initio evaluation of the potential use of Sc-based III-nitrides in optoelectronics

    Holec, D., Zhang, S., Fu, W. Y., Humphreys, C. J., Mayrhofer, P. H. & Moram, M. A., 2014.

    Research output: Contribution to conference › Poster › Research › peer-review

  98. Published

    Ab initio studies on the adsorption and adhesive transfer of Al and Fe to nitride coatings materials

    Riedl, H., Zalesak, J., Sobiech, M., Polcik, P., Holec, D. & Mayrhofer, P. H., 2014.

    Research output: Contribution to conference › Poster › Research › peer-review

  99. Published

    Ab initio study of point defects in NiTi-based alloys

    Holec, D., Friák, M., Dlouhý, A. & Neugebauer, J., 2014, In: Physical review : B, Condensed matter and materials physics. 89, p. 0141101-0141106

    Research output: Contribution to journal › Article › Research › peer-review

  100. Published

    A combinatorial X-ray sub-micron diffraction study of microstructure, residual stress and phase stability in TiAlN coatings

    Riedl, A., Daniel, R., Todt, J., Steffenelli, M., Holec, D., Sartory, B., Krywka, C., Müller, M., Mitterer, C. & Keckes, J., 2014, In: Surface & coatings technology. 257, p. 108-113

    Research output: Contribution to journal › Article › Research › peer-review

  101. Published

    Buckling of ZnS-filled single-walled carbon nanotubes - The influence of aspect ratio

    Monteiro, A. O., Costa, P. M. F. J., Cachim, P. B. & Holec, D., 2014, In: Carbon. 79, p. 529-537

    Research output: Contribution to journal › Article › Research › peer-review

  102. Published

    Compositional induced changes in optical response of Si-doped titanium dioxide

    Ondracka, P., Holec, D., Franta, D., Kedronova, E., Elisabeth, S., Goullet, A. & Zajickkova, L., 2014.

    Research output: Contribution to conference › Poster › Research › peer-review

  103. Published

    Composition induced changes in optical response of Si-doped titanium dioxide

    Ondracka, P., Holec, D., Franta, D., Kedronova, E., Elisabeth, S., Goullet, A. & Zajickkova, L., 2014.

    Research output: Contribution to conference › Poster › Research › peer-review

  104. Published

    Computational Materials Science

    Holec, D., 2014.

    Research output: Contribution to conference › Poster › Research › peer-review

  105. Published

    Computational simulation of instability phenomena in nanoparticles and nanofilms

    Todt, M., Toth, F., Hartmann, M., Holec, D., Cordill, M. J., Fischer, F. D. & Rammerstorfer, F. G., 2014, In: Computational Technology Reviews. 10, p. 89-119

    Research output: Contribution to journal › Article › Research › peer-review

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