Real-space numerical grid methods in quantum chemistry
Author:
Affiliation:
1. Centre for Theoretical and Computational Chemistry
2. Department of Chemistry
3. UiT The Arctic University of Norway
4. N-9037 Tromsø
5. Norway
6. University of Helsinki
7. Finland
Abstract
This themed issue reports on recent progress in the fast developing field of real-space numerical grid methods in quantum chemistry.
Publisher
Royal Society of Chemistry (RSC)
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://pubs.rsc.org/en/content/articlepdf/2015/CP/C5CP90198G
Reference26 articles.
1. Numerical hartree-fock methods for diatomic molecules: A partial-wave expansion approach
2. Numerical Hartree–Fock–Slater calculations on diatomic molecules
3. Fully numerical hartree-fock methods for molecules
4. H+2 correlation diagram from finite element calculations
5. H2 solved by the finite element method
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