共 50 条
- [31] Computational analysis of solvent effects on electron transfer in organic radical battery cathode materials ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2015, 249
- [32] SOLVENT SELECTION FOR CHEMICAL REACTIONS: AUTOMATED COMPUTATIONAL SCREENING OF SOLVENTS USING THE SMD MODEL QUIMICA NOVA, 2018, 41 (06): : 628 - 633
- [33] Thermodynamic approach for exploring catalytic pathways using high accuracy computational methods ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2016, 251
- [35] Effects of conformation on the stereochemistry of solvent attack on benzylic β-hydroxycarbocations:: Mechanisms of epoxide hydrolysis reactions JOURNAL OF ORGANIC CHEMISTRY, 2006, 71 (19): : 7252 - 7260
- [36] Dramatic effects of halogen substitution and solvent on the rates and mechanisms of nucleophilic substitution reactions of aziridines JOURNAL OF ORGANIC CHEMISTRY, 2008, 73 (07): : 2510 - 2517
- [37] Exploring mechanisms of reactions in microporous catalysts using electronic structure techniques. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1999, 217 : U704 - U704
- [39] Quantifying the many possible hydrolysis reactions of nitroaromatic compounds using computational methods ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2013, 246