Second-order Møller–Plesset perturbation (MP2) theory at finite temperature: relation with Surján’s density matrix MP2 and its application to linear-scaling divide-and-conquer method

Theoretical Chemistry Accounts

Volumn 134, Issue 9, 2015, Pages

  Kobayashi, Masato ^a,b   Taketsugu, Tetsuya ^a,b  

^a HOKKAIDO UNIVERSITY   (Japan)

^b KYOTO UNIVERSITY   (Japan)

Author keywords

Fractional occupation number; Laplace transformed M ller Plesset perturbation; Linear scaling electronic structure method; Many body perturbation theory

Indexed keywords

EID: 84939194146     PISSN: 1432881X     EISSN: None     Source Type: Journal    
DOI: 10.1007/s00214-015-1710-y     Document Type: Article

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