10
0
mirror of https://github.com/LCPQ/quantum_package synced 2024-11-07 14:43:56 +01:00
quantum_package/plugins/MP2/H_apply.irp.f
Thomas Applencourt 6a91e63cf3 Move into plugins
2015-06-17 18:23:56 +02:00

11 lines
195 B
Fortran

use bitmasks
BEGIN_SHELL [ /usr/bin/env python ]
from generate_h_apply import *
from perturbation import perturbations
s = H_apply("mp2")
s.set_perturbation("Moller_plesset")
print s
END_SHELL