Fundamental Variable and Density Representation in Multistate DFT for Excited States
Author:
Affiliation:
1. Institute of Systems and Physical Biology, Shenzhen Bay Laboratory, Shenzhen518055, China
2. Department of Chemistry and Supercomputing Institute, University of Minnesota, Minneapolis, Minnesota55455, United States
Funder
Shenzhen Bay Laboratory
National Institutes of Health
Shenzhen Municipal Science and Technology Innovation Commission
Guangdong Province
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.2c00859
Reference35 articles.
1. Inhomogeneous Electron Gas
2. Self-Consistent Equations Including Exchange and Correlation Effects
3. Parr, R. G.; Yang, W. Density Functional Theory of Atoms and Molecules; Oxford University Press: New York, 1989; p 352.
4. Perspective: Fifty years of density-functional theory in chemical physics
5. The energy density functional formalism for excited states
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