Efficient iterative method for solving the Dirac-Kohn-Sham density functional theory (Q347712): Difference between revisions
From MaRDI portal
Created a new Item |
Changed an Item |
||
Property / Mathematics Subject Classification ID | |||
Property / Mathematics Subject Classification ID: 65H10 / rank | |||
Normal rank | |||
Property / zbMATH DE Number | |||
Property / zbMATH DE Number: 6659708 / rank | |||
Normal rank | |||
Property / zbMATH Keywords | |||
relativistic density functional theory | |||
Property / zbMATH Keywords: relativistic density functional theory / rank | |||
Normal rank | |||
Property / zbMATH Keywords | |||
Dirac-Kohn-Sham equations | |||
Property / zbMATH Keywords: Dirac-Kohn-Sham equations / rank | |||
Normal rank | |||
Property / zbMATH Keywords | |||
spin-orbit coupling | |||
Property / zbMATH Keywords: spin-orbit coupling / rank | |||
Normal rank | |||
Property / zbMATH Keywords | |||
iterative methods | |||
Property / zbMATH Keywords: iterative methods / rank | |||
Normal rank | |||
Property / zbMATH Keywords | |||
LOBPCG-F | |||
Property / zbMATH Keywords: LOBPCG-F / rank | |||
Normal rank | |||
Property / zbMATH Keywords | |||
variational collapse | |||
Property / zbMATH Keywords: variational collapse / rank | |||
Normal rank | |||
Property / zbMATH Keywords | |||
spectral pollution | |||
Property / zbMATH Keywords: spectral pollution / rank | |||
Normal rank |
Revision as of 08:42, 28 June 2023
scientific article
Language | Label | Description | Also known as |
---|---|---|---|
English | Efficient iterative method for solving the Dirac-Kohn-Sham density functional theory |
scientific article |
Statements
Efficient iterative method for solving the Dirac-Kohn-Sham density functional theory (English)
0 references
5 December 2016
0 references
relativistic density functional theory
0 references
Dirac-Kohn-Sham equations
0 references
spin-orbit coupling
0 references
iterative methods
0 references
LOBPCG-F
0 references
variational collapse
0 references
spectral pollution
0 references