First-principles study of interface structure and energy of Fe/NbC

Modelling and Simulation in Materials Science and Engineering

Volumn 21, Issue 4, 2013, Pages

  Sawada, H ^a   Taniguchi, S ^a   Kawakami, K ^a   Ozaki, T ^b  

^a NIPPON STEEL CORPORATION   (Japan)

^b JAPAN ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

CLASSICAL MOLECULAR DYNAMICS; DISLOCATION CORE STRUCTURE; ELECTRONIC STRUCTURE CALCULATIONS; FIRST-PRINCIPLES STUDY; KRYLOV-SUBSPACE METHODS; RECTANGULAR PARALLELEPIPEDS; SEMI-COHERENT INTERFACES; SEMI-COHERENT PRECIPITATES;

CALCULATIONS; ELECTRONIC STRUCTURE; MOLECULAR DYNAMICS; STRAIN ENERGY;

PRECIPITATES;

EID: 84878323739     PISSN: 09650393     EISSN: 1361651X     Source Type: Journal    
DOI: 10.1088/0965-0393/21/4/045012     Document Type: Article

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