Thermochemical Values of Oxygen-Containing Compounds from ab Initio Calculations: 2. High Accuracy Enthalpies of Formation of Alcohols and Ethers
Author:
Affiliation:
1. Department of Chemistry, Florida State University, Tallahassee, Florida 32306
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp004000x
Reference59 articles.
1. Thermochemical Values of Oxygen-Containing Compounds from ab Initio Calculations. 1. Enthalpies of Formation of Ethers and Alcohols
2. Irikura, K. K., Frurip, D. J., Eds.Computational Thermochemistry, ACS Synposium Series 677 ed.; American Chemical Society: Washington, D.C., 1997.
3. Gaussian‐2 theory for molecular energies of first‐ and second‐row compounds
4. Heats of Formation from G2, G2(MP2), and G2(MP2,SVP) Total Energies
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