Including the effects of pressure and stress in thermodynamic functions

Physica Status Solidi (B) Basic Research

Volumn 251, Issue 1, 2014, Pages 81-96

  Hammerschmidt, T ^a   Abrikosov, I A ^b   Alfe D ^c   Fries, S G ^a   Hoglund L ^d   Jacobs, M H G ^e   Kossmann J ^a   Lu, X G ^f   Paul, G ^g  

^a RUHR UNIVERSITY BOCHUM   (Germany)

^b LINKÖPING UNIVERSITY   (Sweden)

^c UNIVERSITY COLLEGE LONDON   (United Kingdom)

^d ROYAL INSTITUTE OF TECHNOLOGY   (Sweden)

^e CLAUSTHAL UNIVERSITY OF TECHNOLOGY   (Germany)

^f SHANGHAI UNIVERSITY   (China)

^g THYSSENKRUPP STEEL EUROPE AG   (Germany)

Author keywords

CALPHAD; DFT calculations; Elastic constants; Pressure; Strain

Indexed keywords

CALCULATIONS; CRYSTAL STRUCTURE; DATABASE SYSTEMS; DESIGN FOR TESTABILITY; ELASTIC CONSTANTS; MAGNETISM; PRESSURE; STRAIN;

CALPHAD; CHEMICAL COMPOSITIONS; DFT CALCULATION; DYNAMICAL INSTABILITIES; FIRST-PRINCIPLES CALCULATION; IMPLEMENTATION SCHEME; THERMODYNAMIC DATABASE; THERMODYNAMIC FUNCTIONS;

TEMPERATURE;

EID: 84892451269     PISSN: 03701972     EISSN: 15213951     Source Type: Journal    
DOI: 10.1002/pssb.201350156     Document Type: Article

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