Extensivity of energy and electronic and vibrational structure methods for crystals

Annual Review of Physical Chemistry

Volumn 63, Issue , 2012, Pages 131-153

  Hirata, So ^a   Keçeli, Murat ^a   Ohnishi, Yu Ya ^a   Sode, Olaseni ^a   Yagi, Kiyoshi ^a  

^a UNIVERSITY OF ILLINOIS AT URBANA CHAMPAIGN   (United States)

Author keywords

Diagrams; Extensive quantities; Intensive quantities; Lattice sums; Size consistency; Thermodynamic limit

Indexed keywords

CRYSTAL STRUCTURE;

DIAGRAM; ELECTRONIC.STRUCTURE; ENERGY; EXTENSIVE QUANTITY; EXTENSIVITY; INTENSIVE QUANTITY; LATTICE SUM; SIZE-CONSISTENCY; THERMODYNAMIC LIMITS; VIBRATIONAL STRUCTURES;

WAVE FUNCTIONS;

EID: 84859916199     PISSN: 0066426X     EISSN: None     Source Type: Book Series    
DOI: 10.1146/annurev-physchem-032511-143718     Document Type: Review

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