Localized orbital corrections applied to thermochemical errors in density functional theory: The role of basis set and application to molecular reactions
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.3008062
Reference27 articles.
1. A localized orbital analysis of the thermochemical errors in hybrid density functional theory: Achieving chemical accuracy via a simple empirical correction scheme
2. Localized Orbital Corrections for the Calculation of Ionization Potentials and Electron Affinities in Density Functional Theory
3. A new mixing of Hartree–Fock and local density‐functional theories
4. Density‐functional thermochemistry. III. The role of exact exchange
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