PAVLŮ, Jana, Jan VŘEŠŤÁL and Mojmír ŠOB. Thermodynamic modeling of Laves phases in the Cr-Hf and Cr-Ti systems: Reassessment using first-principles results. CALPHAD-COMPUTER COUPLING OF PHASE DIAGRAMS AND THERMOCHEMISTRY. OXFORD: PERGAMON-ELSEVIER SCIENCE LTD, 2010, vol. 34, No 2, p. 215-221. ISSN 0364-5916. doi:10.1016/j.calphad.2010.03.003.
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Basic information
Original name Thermodynamic modeling of Laves phases in the Cr-Hf and Cr-Ti systems: Reassessment using first-principles results
Authors PAVLŮ, Jana (203 Czech Republic, guarantor, belonging to the institution), Jan VŘEŠŤÁL (203 Czech Republic, belonging to the institution) and Mojmír ŠOB (203 Czech Republic, belonging to the institution).
Edition CALPHAD-COMPUTER COUPLING OF PHASE DIAGRAMS AND THERMOCHEMISTRY, OXFORD, PERGAMON-ELSEVIER SCIENCE LTD, 2010, 0364-5916.
Other information
Original language English
Type of outcome Article in a journal
Field of Study 20303 Thermodynamics
Country of publisher United Kingdom of Great Britain and Northern Ireland
Confidentiality degree is not subject to a state or trade secret
Impact factor Impact factor: 1.434
RIV identification code RIV/00216224:14310/10:00049638
Organization unit Faculty of Science
Doi http://dx.doi.org/10.1016/j.calphad.2010.03.003
UT WoS 000279217700009
Keywords in English ab initio calculations; Laves phases; phase diagram
Tags AKb, Phase stability, rivok
Tags International impact, Reviewed
Changed by Changed by: Ing. Andrea Mikešková, učo 137293. Changed: 20/4/2012 09:43.
Abstract
On the basis of ab initio electronic structure calculations, we provided a thermodynamic modelling of Laves phases and a reliable construction of the phase diagram of the Cr-Ti and Cr-Hf systems.
Abstract (in Czech)
Na základě výpočtů elektronové struktury a celkové energie je provedeno termodynamické modelování Lavesových fází a konstrukce fázového diagramu soustav Cr-Ti and Cr-Hf.
Links
GAP108/10/1908, research and development projectName: Termodynamika intermetalických fází z pohledu teoretických a experimentálních přístupů
Investor: Czech Science Foundation, Standard Projects
GA106/07/1078, research and development projectName: Teoretické a experimentální studium termodynamických vlastností intermetalických fází na bázi přechodných kovů
Investor: Czech Science Foundation, Standard Projects
MSM0021622410, plan (intention)Name: Fyzikální a chemické vlastnosti pokročilých materiálů a struktur
Investor: Ministry of Education, Youth and Sports of the CR, Research Intents
OC 164, research and development projectName: Víceúrovňové modelování struktury a vlastností intermetalických fází
Investor: Ministry of Education, Youth and Sports of the CR, COST
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