Concepedia

Numerical solution of singular ODE eigenvalue problems in electronic structure computations

Robert Hammerling, Othmar Koch, Christa Simon, Ewa Weinmüller

Computer Physics Communications · 2010 · 18 citations · 25 references

DOI

Concepts

References

25

A multiconfiguration relativistic DIRAC-FOCK program

J. P. Desclaux · Computer Physics Communications · 1975 · 1.6K citations

, , +7

An improved eigenvalue corrector formula for solving the Schrödinger equation for central fields

J.W. Cooley · Mathematics of Computation · 1961 · 1.1K citations · Full text

, , +14

The Calculation of Atomic Structures

E.H. Bareiss, D. R. Hartree · Mathematics of Computation · 1960 · 638 citations

, , +12

The calculation of atomic structures

Per‐Olov Löwdin · Journal of Physics and Chemistry of Solids · 1958 · 443 citations

, , +12

Hartree Fock Slater self consistent field calculations

J. P. Desclaux · Computer Physics Communications · 1970 · 186 citations

, , +13