What Can We Learn about Dispersion from the Conformer Surface of n-Pentane?
Author:
Affiliation:
1. Department of Chemistry and Center for Advanced Scientific Computing and Modeling (CASCaM), University of North Texas, Denton, Texas 76201, United States
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp401429u
Reference113 articles.
1. The IUPAC Compendium of Chemical Terminology
2. IUPAC Gold Book, entry “Conformation”, http://goldbook.iupac.org/C01258.html(accessed February 9, 2011) .
3. IUPAC Gold Book,entry “Conformer”, http://goldbook.iupac.org/C01262.html(accessed February 9, 2011) .
4. Performance of Ab Initio and Density Functional Methods for Conformational Equilibria of CnH2n+2 Alkane Isomers (n = 4−8)
5. Benchmark Thermochemistry of the CnH2n+2 Alkane Isomers (n = 2−8) and Performance of DFT and Composite Ab Initio Methods for Dispersion-Driven Isomeric Equilibria
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