Efficient symmetry treatment for the nonrelativistic and relativistic molecular Kohn–Sham problem. The symmetry module of the program ParaGauss
Author:
Publisher
Elsevier BV
Subject
General Physics and Astronomy,Hardware and Architecture
Reference60 articles.
1. Chemical Application of Group Theory;Cotton,1990
2. Addendum to construction of linearly independent relativistic symmetry orbitals for finite double-point groups including time-reversal symmetry
3. Computer Generation of Molecular Symmetry Orbitals
4. Symmetry adaption
5. Symmetry determined orbital and group overlap
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