Direct minimization for calculating invariant subspaces in density functional computations of the electronic structure (Q3572305)
From MaRDI portal
scientific article
| Language | Label | Description | Also known as |
|---|---|---|---|
| English | Direct minimization for calculating invariant subspaces in density functional computations of the electronic structure |
scientific article |
Statements
8 July 2010
0 references
eigenvalue computation
0 references
Grassmann manifolds
0 references
optimization
0 references
orthogonality constraints
0 references
Hartree-Fock theory
0 references
density functional theory
0 references
electronic structure
0 references
math.NA
0 references
