qs_scf_types::subspace_env_type Type Reference

Data Fields
integer	max_iter
integer	mixing_method
real(dp)	eps_diag_sub
real(dp)	eps_ene
real(dp)	eps_adapt
type(dbcsr_p_type), dimension(:), pointer	p_matrix_store
type(dbcsr_p_type), dimension(:, :), pointer	p_matrix_mix
type(cp_fm_type), dimension(:), pointer	chc_mat
type(cp_fm_type), dimension(:), pointer	c_vec
type(cp_fm_type), dimension(:), pointer	c0
type(mixing_storage_type), pointer	mixing_store

Detailed Description

Definition at line 82 of file qs_scf_types.F.

Field Documentation

max_iter

integer qs_scf_types::subspace_env_type::max_iter

Definition at line 83 of file qs_scf_types.F.

mixing_method

integer qs_scf_types::subspace_env_type::mixing_method

Definition at line 83 of file qs_scf_types.F.

eps_diag_sub

real(dp) qs_scf_types::subspace_env_type::eps_diag_sub

Definition at line 84 of file qs_scf_types.F.

eps_ene

real(dp) qs_scf_types::subspace_env_type::eps_ene

Definition at line 84 of file qs_scf_types.F.

eps_adapt

real(dp) qs_scf_types::subspace_env_type::eps_adapt

Definition at line 84 of file qs_scf_types.F.

p_matrix_store

type(dbcsr_p_type), dimension(:), pointer qs_scf_types::subspace_env_type::p_matrix_store

Definition at line 85 of file qs_scf_types.F.

p_matrix_mix

type(dbcsr_p_type), dimension(:, :), pointer qs_scf_types::subspace_env_type::p_matrix_mix

Definition at line 86 of file qs_scf_types.F.

chc_mat

type(cp_fm_type), dimension(:), pointer qs_scf_types::subspace_env_type::chc_mat

Definition at line 87 of file qs_scf_types.F.

c_vec

type(cp_fm_type), dimension(:), pointer qs_scf_types::subspace_env_type::c_vec

Definition at line 87 of file qs_scf_types.F.

c0

type(cp_fm_type), dimension(:), pointer qs_scf_types::subspace_env_type::c0

Definition at line 87 of file qs_scf_types.F.

mixing_store

type(mixing_storage_type), pointer qs_scf_types::subspace_env_type::mixing_store

Definition at line 88 of file qs_scf_types.F.

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The documentation for this type was generated from the following file:

• qs_scf_types.F