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freebsd-ports/science/2dhf/pkg-descr
Maho Nakata 4d3ec3c9cd * Migrate to gfortran
* Update to 2005.05 version
* Change master site
2007-01-09 08:54:01 +00:00

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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