Professor Jan Vřešťál and His Contributions Towards the Implementing of Ab Initio Data into the CALPHAD Method and Extension of the Phase Diagram Calculations Down to 0 K

0504186 - ÚFM 2020 RIV US eng J - Článek v odborném periodiku
Kroupa, Aleš - Pavlů, Jana - Šob, Mojmír
Professor Jan Vřešťál and His Contributions Towards the Implementing of Ab Initio Data into the CALPHAD Method and Extension of the Phase Diagram Calculations Down to 0 K.
Journal of Phase Equilibria and Diffusion. Roč. 40, č. 1 (2019), s. 3-9. ISSN 1547-7037. E-ISSN 1863-7345
Institucionální podpora: RVO:68081723
Klíčová slova: ab initio methods * alloys * CALPHAD approach * computational studies * intermetallics * phase diagram
Obor OECD: Thermodynamics
Impakt faktor: 1.315, rok: 2019
Způsob publikování: Omezený přístup
https://link.springer.com/article/10.1007%2Fs11669-018-0704-6

The paper describes the development of implementation of ab initio results into the CALPHAD method and of calculations of phase diagrams down to 0 K, where Prof. Jan Vřešťál is among pioneers paving new ways. His scientific activities contributed considerably to improved versatility and effectivity of the CALPHAD method, which was supported by numerous descriptions of binary and ternary systems accomplished with the help of data having stronger physical grounds and thus bringing more physics into the CALPHAD approach. He also brought the CALPHAD method to Czechoslovak scientific institutions and, due to his merit, numerous younger colleagues learned to apply this very effective approach.
Trvalý link: http://hdl.handle.net/11104/0300112