(git:1f285aa)
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#include "../base/base_uses.f90"
Go to the source code of this file.
Modules | |
module | cg_utils |
Utilities for Geometry optimization using Conjugate Gradients. | |
Functions/Subroutines | |
recursive subroutine, public | cg_utils::cg_linmin (gopt_env, xvec, xi, g, opt_energy, output_unit, gopt_param, globenv) |
Main driver for line minimization routines for CG. More... | |
subroutine, public | cg_utils::get_conjugate_direction (gopt_env, Fletcher_Reeves, g, xi, h) |
Computes the Conjugate direction for the next search. More... | |