Calculation of the static electronic second hyperpolarizability or (3) tensor of three-dimensional periodic compounds with a local basis set

Journal of Chemical Physics

Volumn 131, Issue 18, 2009, Pages

  Orlando, Roberto ^a   Ferrero, Mauro ^b   Ŕrat, Michel ^c   Kirtman, Bernard ^d   Dovesi, Roberto ^b  

^a UNIVERSITY OF EASTERN PIEDMONT   (Italy)

^b UNIVERSITY OF TURIN   (Italy)

^c UNIVERSITÉ DE PAU ET DES PAYS DE L'ADOUR   (France)

^d UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

BAND GAPS; BASIS SETS; COMPUTATIONAL PROTOCOLS; EXPERIMENTAL VALUES; HARTREE-FOCK; HIGH SYMMETRY; HYPER-POLARIZABILITY; PERIODIC SYSTEM; SECOND HYPERPOLARIZABILITIES; SECOND-ORDER HYPERPOLARIZABILITIES; THREE DIMENSIONAL SYSTEMS; UNIT CELLS;

GARNETS; THREE DIMENSIONAL;

TENSORS;

EID: 72949108418     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3263919     Document Type: Article

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