CP2K 2.4 (Revision 12889)
Private Attributes

qs_matrix_pools::qs_matrix_pools_type Struct Reference

container for the pools of matrixes used by qs More...

Collaboration diagram for qs_matrix_pools::qs_matrix_pools_type:

List of all members.

Private Attributes

INTEGER id_nr
INTEGER ref_count
TYPE(cp_fm_pool_p_type),
dimension(:), pointer 
ao_mo_fm_pools
TYPE(cp_fm_pool_p_type),
dimension(:), pointer 
ao_ao_fm_pools
TYPE(cp_fm_pool_p_type),
dimension(:), pointer 
mo_mo_fm_pools
TYPE(cp_fm_pool_p_type),
dimension(:), pointer 
ao_mosub_fm_pools
TYPE(cp_fm_pool_p_type),
dimension(:), pointer 
mosub_mosub_fm_pools

Detailed Description

container for the pools of matrixes used by qs

Parameters:
id_nridentification number
ref_countreference count (see doc/ReferenceCounting.html)
ao_mo_fm_poolspools with (ao x mo) full matrixes (same order as c).
ao_ao_fm_poolspools with (ao x ao) full matrixes (same order as c).
mo_mo_fm_poolspools with (mo x mo) full matrixes (same order as c).
ao_mosub_fm_poolspools with (ao x mosub) full matrixes, where mosub are a subset of the mos
mosub_mosub_fm_poolspools with (mosub x mosub) full matrixes, where mosub are a subset of the mos
maxao_maxao_fm_poolspool of matrixes big enough to accomodate any aoxao matrix (useful for temp matrixes)
maxao_maxmo_fm_poolspool of matrixes big enough to accomodate any aoxmo matrix (useful for temp matrixes)
maxmo_maxmo_fm_poolspool of matrixes big enough to accomodate any moxmo matrix (useful for temp matrixes)
History
04.2003 created [fawzi]
Author:
fawzi

Definition at line 70 of file qs_matrix_pools.f90.


Member Data Documentation

Definition at line 72 of file qs_matrix_pools.f90.

Definition at line 72 of file qs_matrix_pools.f90.

Definition at line 74 of file qs_matrix_pools.f90.

Definition at line 71 of file qs_matrix_pools.f90.

Definition at line 72 of file qs_matrix_pools.f90.

Definition at line 74 of file qs_matrix_pools.f90.

Definition at line 71 of file qs_matrix_pools.f90.


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