Ab initio based thermodynamic modeling below room temperature: Hf-V system

PAVLŮ, Jana, Jan VŘEŠŤÁL, Urszula, D. WDOWIK and Mojmír ŠOB. Ab initio based thermodynamic modeling below room temperature: Hf-V system. In CALPHAD XLIV, Loano, Italy. 2015.

Basic information

• Original name: Ab initio based thermodynamic modeling below room temperature: Hf-V system
• Name in Czech: Termodynamické modelování pod pokojovou teplotou: soustava Hf-V
• Authors: PAVLŮ, Jana (203 Czech Republic, guarantor), Jan VŘEŠŤÁL (203 Czech Republic, belonging to the institution), Urszula, D. WDOWIK (616 Poland) and Mojmír ŠOB (203 Czech Republic, belonging to the institution).
• Edition: CALPHAD XLIV, Loano, Italy, 2015.

Other information

• Original language: English
• Type of outcome: Conference abstract
• Field of Study: 20303 Thermodynamics
• Country of publisher: Italy
• Confidentiality degree: is not subject to a state or trade secret
• RIV identification code: RIV/00216224:14740/15:00080878
• Organization unit: Central European Institute of Technology
• Keywords (in Czech): Ab initio výpočty; termodynamické modelování; teploty pod 0 oC; soustava Hf-V
• Keywords in English: Ab initio calculations; thermodynamic modeling; temperature below 0 oC; Hf-V system

Abstract

Phase transformations in Hf-V system below room te mperature were modelled based on ab initio calculated energy of formation of Laves phase HfV2.

Abstract (in Czech)

Fázové transformace v soustavě Hf-V pod pokojovou teplotou byly modelovány na základě ab initio vypočtených energií tvorby Lavesovy fáze HfV2.

Links

• ED1.1.00/02.0068, research and development project: Name: CEITEC - central european institute of technology
• GA14-15576S, research and development project: Name: Komplexní studium fázových diagramů pokročilých kovových materiálů, kombinující ab initio a semiempirické modelování s experimentálními postupy

Investor: Czech Science Foundation