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(git:ed6f26b)
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#include "./base/base_uses.f90"
Go to the source code of this file.
Data Types | |
type | mscfg_types::molecular_scf_guess_env_type |
Modules | |
module | mscfg_types |
Types used to generate the molecular SCF guess. | |
Functions/Subroutines | |
subroutine, public | mscfg_types::molecular_scf_guess_env_init (env, nfrags) |
Allocates data. | |
subroutine, public | mscfg_types::molecular_scf_guess_env_destroy (env) |
Destroyes both data and environment. | |
subroutine, public | mscfg_types::get_matrix_from_submatrices (mscfg_env, matrix_out, iset) |
Creates a distributed matrix from MOs on fragments. | |
Variables | |
integer, parameter, public | mscfg_types::mscfg_max_moset_size = 2 |