Concepedia

BNDPKG. A package of programs for the calculation of electronic energy bands by the LCGO method

C.S. Wang, J. Callaway

Computer Physics Communications · 1984 · 15 citations · 13 references

DOI

Concepts

References

13

Self-Consistent Equations Including Exchange and Correlation Effects

W. Kohn, L. J. Sham · Physical Review · 1965 · 63.2K citations · Full text

, , +15

A Simplification of the Hartree-Fock Method

J. C. Slater · Physical Review · 1951 · 4.5K citations

, , +10

Gaussian Basis Set for Molecular Wavefunctions Containing Third-Row Atoms

Arthur J. H. Wachters · The Journal of Chemical Physics · 1970 · 3.4K citations

, , +13

Gaussian-Type Functions for Polyatomic Systems. II

Sigeru Huzinaga, Yoshiko Sakai · The Journal of Chemical Physics · 1969 · 3.2K citations

, , +15

On the Numerical Calculation of the Density of States and Related Properties

G. Lehmann, M. Taut · physica status solidi (b) · 1972 · 1.3K citations

, , +14