(git:6a2e663)
rt_projection_mo_utils.F File Reference

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Modules

module  rt_projection_mo_utils
 Function related to MO projection in RTP calculations.
 

Functions/Subroutines

subroutine, public rt_projection_mo_utils::init_mo_projection (qs_env, rtp_control)
 Initialize the mo projection objects for time dependent run. More...
 
subroutine, public rt_projection_mo_utils::compute_and_write_proj_mo (qs_env, mos_new, proj_mo, n_proj)
 Compute the projection of the current MO coefficients on reference ones and write the results. More...