mp2_gpw_method.F File Reference

#include "./base/base_uses.f90"

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Modules
module	mp2_gpw_method
	Routines to calculate MP2 energy using GPW method.

Functions/Subroutines
subroutine, public	mp2_gpw_method::mp2_gpw_compute (emp2, emp2_cou, emp2_ex, qs_env, para_env, para_env_sub, color_sub, cell, particle_set, atomic_kind_set, qs_kind_set, mo_coeff, eigenval, nmo, homo, mat_munu, sab_orb_sub, mo_coeff_o, mo_coeff_v, eps_filter, unit_nr, mp2_memory, calc_ex, blacs_env_sub, emp2_ab)
	...