Describing Anions by Density Functional Theory: Fractional Electron Affinity
Author:
Affiliation:
1. Department of Chemistry, University of Aarhus, Langelandsgade 140, DK-8000 Aarhus, Denmark
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/ct1003324
Reference52 articles.
1. A Chemist's Guide to Density Functional Theory
2. Inhomogeneous Electron Gas
3. Density‐functional thermochemistry. III. The role of exact exchange
4. Ab Initio Calculation of Vibrational Absorption and Circular Dichroism Spectra Using Density Functional Force Fields
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