Research output

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2017
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
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
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
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
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
Published
Optimised structural models of solid slotions for tensorial properties
Nöger, D. & Holec, D., 2017.
Research output: Contribution to conference › Poster › Research
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
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
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
2016
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

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Research Portal

Research output

Atomistic modelling-based design of novel materials

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

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

Mechaniical and structural properties of CrN/AlN superlattices

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

Optimised structural models of solid slotions for tensorial properties

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

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

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

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

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