quantum_package/src/CID/H_apply.irp.f

! Generates subroutine H_apply_cisd
! ----------------------------------

BEGIN_SHELL [ /usr/bin/env python ]
from generate_h_apply import H_apply
H = H_apply("cisd",do_double_exc=True,do_mono_exc=False)
print H
END_SHELL
add CID, CID_selected, CID_SC2_selected, just for fun ... 2014-06-11 00:44:07 +02:00			`! Generates subroutine H_apply_cisd`
			`! ----------------------------------`

			`BEGIN_SHELL [ /usr/bin/env python ]`
			`from generate_h_apply import H_apply`
Put do_mono/diexcitations in generate_h_apply.py 2014-06-20 15:23:04 +02:00			`H = H_apply("cisd",do_double_exc=True,do_mono_exc=False)`
add CID, CID_selected, CID_SC2_selected, just for fun ... 2014-06-11 00:44:07 +02:00			`print H`
			`END_SHELL`