Work

Theoretical Atomic Charges vs Experimental Observables: Assessment of Predictions by Density Functionals

Year: 2025

Type: article

Source: The Journal of Organic Chemistry

DOI: 10.1021/acs.joc.5c01461

Authors: Boris Galabov, Diana Cheshmedzhieva, Ivan Atanasov, Sonia Ilieva, Henry F. Schaefer

Institutions: Sofia University "St. Kliment Ohridski", University of Georgia

Language: English

Topic: Advanced Chemical Physics Studies

Subfield: Atomic and Molecular Physics, and Optics

Field: Physics and Astronomy

Domain: Physical Sciences

Open Access status: closed

Funders: U.S. Department of Energy, NextGenerationEU

Awards: THEORETICAL AND EXPERIMENTAL STUDIES OF ELEMENTARY HYDROCARBON SPECIES AND THEIR REACTIONS, G6591462519

OpenAlex ID: W4413258441

FWCI: 1.111

Cites: 56

Cited by: 3

Related to: 10