Publikationen

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2014
Veröffentlicht
Structural stability and thermodynamics of CrN magnetic phases from ab initio calculations and experiment
Zhou, L., Körmann, F., Holec, D., Bartosik, M., Grabowski, B., Neugebauer, J. & Mayrhofer, P. H., 2014, in: Physical review : B, Condensed matter and materials physics. 90, S. 184102-1-184102-12
Publikationen: Beitrag in Fachzeitschrift › Artikel › Forschung › (peer-reviewed)
Veröffentlicht
Structural stability and thermodynamics of CrN magnetic phases from first principles
Holec, D., Zhou, L., Bartosik, M., Körmann, F., Grabowski, B., Neugebauer, J. & Mayrhofer, P. H., 2014.
Publikationen: Konferenzbeitrag › Poster › Forschung › (peer-reviewed)
Veröffentlicht
Structure and mechanical properties of Ta alloyed Cr-Al-N coatings
Hollerweger, R., Zhou, L., Holec, D., Rachbauer, R., Polcik, P. & Mayrhofer, P. H., 2014.
Publikationen: Konferenzbeitrag › Poster › Forschung › (peer-reviewed)
Veröffentlicht
The effect of interlayer composition and thickness on the stabilization of cubic AlN in AlN/Ti-Al-N superlattices
Chawla, V., Holec, D. & Mayrhofer, P., 2014, in: Thin solid films. 565, S. 94-100
Publikationen: Beitrag in Fachzeitschrift › Artikel › Forschung › (peer-reviewed)
Veröffentlicht
The origin of carbon nanotubes G-mode upshift under pressure: out -of-plane compression effects in in-plane bond strength
Sun, Y. W., Holec, D. & Dunstan, D. J., 2014.
Publikationen: Konferenzbeitrag › Poster › Forschung › (peer-reviewed)
Veröffentlicht
Thermal expansion and elasticity of metastable cubic B1-AlN
Bartosik, M., Holec, D., Todt, M., Todt, J., Rammerstorfer, F. G. & Mayrhofer, P. H., 2014.
Publikationen: Konferenzbeitrag › Poster › Forschung › (peer-reviewed)
Veröffentlicht
Thermal properties of Ti-Al alloys: A combined theoretical and experimental approach
Holec, D., Schmölzer, T., Legut, D., Staron, P. & Clemens, H., 2014.
Publikationen: Konferenzbeitrag › Poster › Forschung › (peer-reviewed)
2013
Veröffentlicht
Ab initio study of the alloying effect of transition metals on structure, stability and ductility of CrN
Zhou, L., Holec, D. & Mayrhofer, P. H., 2013, in: Journal of physics / D, Applied physics. 46, S. 3653011-3653017
Publikationen: Beitrag in Fachzeitschrift › Artikel › Forschung › (peer-reviewed)
Veröffentlicht
Alloy-based design of materials from first principles: an application to functional hard coatings
Holec, D., Zhou, L., Rachbauer, R. & Mayrhofer, P. H., 2013, Density Functional Theory. S. 259-284
Publikationen: Beitrag in Buch/Bericht/Konferenzband › Beitrag in Buch/Sammelband › Forschung
Veröffentlicht
Alloying-related trends from first principles: An application to the Ti-Al-X-N system
Holec, D., Zhou, L., Rachbauer, R. & Mayrhofer, P. H., 2013, in: Journal of applied physics. 113, S. 113510-1-113510-8
Publikationen: Beitrag in Fachzeitschrift › Artikel › Forschung › (peer-reviewed)

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Forschungsportal

Publikationen

Structural stability and thermodynamics of CrN magnetic phases from ab initio calculations and experiment

Structural stability and thermodynamics of CrN magnetic phases from first principles

Structure and mechanical properties of Ta alloyed Cr-Al-N coatings

The effect of interlayer composition and thickness on the stabilization of cubic AlN in AlN/Ti-Al-N superlattices

The origin of carbon nanotubes G-mode upshift under pressure: out -of-plane compression effects in in-plane bond strength

Thermal expansion and elasticity of metastable cubic B1-AlN

Thermal properties of Ti-Al alloys: A combined theoretical and experimental approach

Ab initio study of the alloying effect of transition metals on structure, stability and ductility of CrN

Alloy-based design of materials from first principles: an application to functional hard coatings

Alloying-related trends from first principles: An application to the Ti-Al-X-N system

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