Research output

  1. 2016
  2. Published

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

    Holec, D., 1 Nov 2016.

    Research output: Contribution to conferencePresentationResearch

  3. Published

    Application of first principles methods in developments of novel intermetallic alloys

    Holec, D., 29 Aug 2016.

    Research output: Contribution to conferencePresentationResearch

  4. Published
  5. 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 conferencePresentationResearch

  6. 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 journalArticleResearch

  7. 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 conferencePresentationResearch

  8. 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 conferencePresentationResearch

  9. 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 conferencePosterResearch

  10. Published
  11. Published

    Cross-sectional structure-property relationship in a graded nanocrystalline Ti1-xAlxN thin film

    Zalesak, J., Bartosik, M., Daniel, R., Mitterer, C., Krywka, C., Kiener, D., Mayrhofer, P. H. & Keckes, J., 2016, In: Acta materialia. 102, p. 212-219 8 p.

    Research output: Contribution to journalArticleResearchpeer-review