Correction to Semi-Experimental Equilibrium Structure Determinations by Employing B3LYP/SNSD Anharmonic Force Fields: Validation and Application to Semirigid Organic Molecules
Author(s) -
Matteo Piccardo,
Emanuele Penocchio,
Cristina Puzzarini,
Małgorzata Biczysko,
Vincenzo Barone
Publication year - 2016
Publication title -
the journal of physical chemistry a
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.756
H-Index - 235
eISSN - 1520-5215
pISSN - 1089-5639
DOI - 10.1021/acs.jpca.6b04648
Subject(s) - anharmonicity , molecule , organic molecules , force field (fiction) , materials science , computational chemistry , chemical physics , statistical physics , nanotechnology , computer science , chemistry , physics , condensed matter physics , organic chemistry , artificial intelligence
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