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cg_optimizer.F File Reference

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Modules

module  cg_optimizer
 Routines for Geometry optimization using Conjugate Gradients.
 

Functions/Subroutines

recursive subroutine, public cg_optimizer::geoopt_cg (force_env, gopt_param, globenv, geo_section, gopt_env, x0, do_update)
 Driver for conjugate gradient optimization technique.