fist_pol_scf.F File Reference

#include "./base/base_uses.f90"

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Modules
module	fist_pol_scf

Functions/Subroutines
subroutine, public	fist_pol_scf::fist_pol_evaluate (atomic_kind_set, multipoles, ewald_env, ewald_pw, fist_nonbond_env, cell, particle_set, local_particles, thermo, vg_coulomb, pot_nonbond, f_nonbond, fg_coulomb, use_virial, pv_g, pv_nonbond, mm_section, do_ipol)
	Main driver for evaluating energy/forces in a polarizable forcefield.