Library for the evaluation of integrals over effective core potentials
Libecpint is a C++ library for the efficient evaluation of integrals over ab initio effective core potentials, using a mixture of generated, recursive code and Gauss-Chebyshev quadrature. It is designed to be standalone and generic, and is now in its first stable release. If you experience any problems please raise an issue here; contributions and suggestions are also welcome.
$
pkg install libecpintOrigin
science/libecpint
Size
3.02MiB
License
MIT
Maintainer
yuri@FreeBSD.org
Dependencies
1 packages
Required by
1 packages