Open AccessHigh-accuracy extrapolated ab initio thermochemistry. IV. A modified recipe for computational efficiency
Author(s) -
James H. Thorpe,
Chris A. Lopez,
Thanh Lam Nguyen,
Joshua H. Baraban,
David H. Bross,
Branko Ruščić,
John F. Stanton
Publication year - 2019
Publication title -
journal of chemical physics online/the journal of chemical physics/journal of chemical physics
Language(s) - English
Resource type - Journals
eISSN - 1089-7690
pISSN - 0021-9606
DOI - 10.1063/1.5095937
Subject(s) - thermochemistry , standard enthalpy of formation , thermodynamics , ab initio , chemistry , benchmark (surveying) , computational chemistry , ab initio quantum chemistry methods , standard enthalpy change of formation , molecule , physics , organic chemistry , geodesy , geography