Improved modification for the density-functional theory calculation of thermodynamic properties for C–H–O composite compounds
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.1847632
Reference20 articles.
1. Gaussian-3 (G3) theory for molecules containing first and second-row atoms
2. Heats of formation and proton affinities by the G3 method
3. Assessment of Gaussian-3 and density functional theories for a larger experimental test set
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5. Gaussian-3X (G3X) theory: Use of improved geometries, zero-point energies, and Hartree–Fock basis sets
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