Density Functional for Spectroscopy: No Long-Range Self-Interaction Error, Good Performance for Rydberg and Charge-Transfer States, and Better Performance on Average than B3LYP for Ground States
Year: 2006
Type: article
DOI: 10.1021/jp066479k
Authors: Yan Zhao, Donald G. Truhlar
Institution: University of Minnesota
Language: English
Subfield: Atomic and Molecular Physics, and Optics
Field: Physics and Astronomy
Domain: Physical Sciences
Open Access status: closed
OpenAlex ID: W2135261522
