4d3ec3c9cd
* Update to 2005.05 version * Change master site
9 lines
338 B
Text
9 lines
338 B
Text
A Numerical Hartree-Fock Program for Diatomic Molecules
|
|
|
|
The program finds virtually exact solution of the Hartree-Fock
|
|
and Hartree-Fock-Slater equations for diatomic molecules. The
|
|
lowest eigenstates of a given irreducible representation and
|
|
spin can be obtained. Distributed under GPL.
|
|
|
|
WWW: http://scarecrow.1g.fi/2d/admin/getit.html
|
|
|