Missing Thermochemical Groups for Large Unsaturated Hydrocarbons: Contrasting Predictions of G2 and CBS-Q
Author:
Affiliation:
1. Department of Chemical Engineering, Massachusetts Institute of Technology, 25 Ames Street, Cambridge, Massachusetts 02139
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp0215320
Reference38 articles.
1. Computer Construction of Detailed Chemical Kinetic Models for Gas-Phase Reactors
2. Revised Group Additivity Values for Enthalpies of Formation (at 298 K) of Carbon–Hydrogen and Carbon–Hydrogen–Oxygen Compounds
3. Sumathi, R.; Green, W. H., Jr.Theor. Chem. Acc.2002,http://dx.doi.org/10.1007/S00214-002-0368-4.
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