Comment on “The hyperpolarizability of trans-butadiene: A critical test case for quantum chemical models” [J. Chem. Phys. 106, 1827 (1997)]
Author(s) -
Bernard Kirtman,
Joseph L. Toto,
Curt M. Breneman,
Celso P. de Melo,
David M. Bishop
Publication year - 1998
Publication title -
the journal of chemical physics
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.071
H-Index - 357
eISSN - 1089-7690
pISSN - 0021-9606
DOI - 10.1063/1.475845
Subject(s) - hyperpolarizability , coupled cluster , basis set , 1,3 butadiene , computational chemistry , quantum chemical , dispersion (optics) , quantum mechanics , quantum , molecular physics , chemistry , physics , statistical physics , molecule , organic chemistry , polarizability , catalysis
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