Metric tensor formulation of strain in density-functional perturbation theory

Physical Review B - Condensed Matter and Materials Physics

Volumn 71, Issue 3, 2005, Pages

  Hamann, D R ^a,b,c   Wu, Xifan ^a   Rabe, Karin M ^a   Vanderbilt, David ^a  

^a RUTGERS UNIVERSITY   (United States)

^b LUCENT TECHNOLOGIES   (United States)

^c Mat Sim Research LLC   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ARTICLE; ATOM; CALCULATION; DENSITY FUNCTIONAL PERTURBATION THEORY; DENSITY FUNCTIONAL THEORY; ELASTICITY; METRIC SYSTEM; PIEZOELECTRICITY; SOLID;

EID: 15444379500     PISSN: 10980121     EISSN: 1550235X     Source Type: Journal    
DOI: 10.1103/PhysRevB.71.035117     Document Type: Article

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