qs_tddfpt2_restart.F File Reference

#include "./base/base_uses.f90"

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Modules
module	qs_tddfpt2_restart

Functions/Subroutines
subroutine, public	qs_tddfpt2_restart::tddfpt_write_restart (evects, evals, gs_mos, logger, tddfpt_print_section)
	Write Ritz vectors to a binary restart file.
integer function, public	qs_tddfpt2_restart::tddfpt_read_restart (evects, evals, gs_mos, logger, tddfpt_section, tddfpt_print_section, fm_pool_ao_mo_occ, blacs_env_global)
	Initialise initial guess vectors by reading (un-normalised) Ritz vectors from a binary restart file.
subroutine, public	qs_tddfpt2_restart::tddfpt_write_newtonx_output (evects, evals, gs_mos, logger, tddfpt_print_section, matrix_s, s_evects, sub_env)
	Write Ritz vectors to a binary restart file.
subroutine, public	qs_tddfpt2_restart::tddfpt_check_orthonormality (evects, ounit, s_evects, matrix_s)
	...