MIT

Green Research Group

Fundamental and Applied Chemical Kinetics

Towards Accurate Quantum Mechanical Thermochemistry: (1) Extensible Implementation and Comparison of Bond Additivity Corrections and Isodesmic Reactions

Submitted on

Title

Towards Accurate Quantum Mechanical Thermochemistry: (1) Extensible Implementation and Comparison of Bond Additivity Corrections and Isodesmic Reactions

Publication Type
Journal Article
Year of Publication
2024

Authors List

Haoyang Wu, A. Mark Payne, Hao-Wei Pang, Angiras Menon, Colin A. Grambow, Duminda Ranasinghe, Xiaorui Dong, Alon Grinberg Dana, and William H. Green

Authors

Journal
Journal of Physical Chemistry A
Volume
128
Issue
Pages
4335-4352

Keywords

doi
http://doi.org/10.1021/acs.jpca.4c00949
URL
Short Title
Journal of Physical Chemistry A