Evaluate the integrals in modern atomic and molecular theory
Libint is a library for evaluating ERI (electron replusion integral) over Cartesian Gaussian fuctions for modern atomic and molecular theory; esp. for science/mpqc and science/psi3.
$
pkg install libintOrigin
science/libint
Size
7.79MiB
License
GPLv2
Maintainer
yuri@FreeBSD.org
Dependencies
0 packages
Required by
5 packages