Applicability of DFTB+ Method for the Calculations of O-H Bond Dissociation Enthalpies of Phenols

Bibliographic Details
Main Authors: Klein, Erik, 1973- (Author), Rimarčík, Ján (Author), Rottmannová, Lenka (Author), Veselý, Tibor (Author), Lukeš, Vladimír, 1971- (Author)
Format: Article
Language:English