Evaluating Hellmann-Feynman forces within non-local pseudopotentials (Q2698863)
From MaRDI portal
scientific article
| Language | Label | Description | Also known as |
|---|---|---|---|
| English | Evaluating Hellmann-Feynman forces within non-local pseudopotentials |
scientific article |
Statements
Evaluating Hellmann-Feynman forces within non-local pseudopotentials (English)
0 references
25 April 2023
0 references
Hellmann-Feynman forces
0 references
separable pseudopotentials
0 references
density functional theory
0 references
convergence
0 references
real-space
0 references
finite element method
0 references
0 references
