A search for a DFT functional for actinide compounds
Author:
Affiliation:
1. Chemistry Department, Moscow State University, Leninskie Gory 1-3, Moscow 119991, Russia
Funder
Russian Science Foundation
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
https://aip.scitation.org/doi/pdf/10.1063/5.0067631
Reference31 articles.
1. Computational Methods in Lanthanide and Actinide Chemistry
2. Inhomogeneous Electron Gas
3. Self-Consistent Equations Including Exchange and Correlation Effects
4. Assessing the ability of DFT methods to describe static electron correlation effects: CO core level binding energies as a representative case
5. Perspective: Kohn-Sham density functional theory descending a staircase
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