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basis_set_types::read_gto_basis_set Interface Reference

Public Member Functions

subroutine read_gto_basis_set1 (element_symbol, basis_set_name, gto_basis_set, para_env, dft_section)
 Read a Gaussian-type orbital (GTO) basis set from the database file.
 
subroutine read_gto_basis_set2 (element_symbol, basis_type, gto_basis_set, basis_section, irep, dft_section)
 Read a Gaussian-type orbital (GTO) basis set from the database file.
 

Detailed Description

Definition at line 110 of file basis_set_types.F.

Member Function/Subroutine Documentation

◆ read_gto_basis_set1()

subroutine basis_set_types::read_gto_basis_set::read_gto_basis_set1 ( character(len=*), intent(in)  element_symbol,
character(len=*), intent(in)  basis_set_name,
type(gto_basis_set_type), intent(inout)  gto_basis_set,
type(mp_para_env_type), pointer  para_env,
type(section_vals_type), pointer  dft_section 
)

Read a Gaussian-type orbital (GTO) basis set from the database file.

Parameters
element_symbol...
basis_set_name...
gto_basis_set...
para_env...
dft_section...
Author
MK

Definition at line 1130 of file basis_set_types.F.

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◆ read_gto_basis_set2()

subroutine basis_set_types::read_gto_basis_set::read_gto_basis_set2 ( character(len=*), intent(in)  element_symbol,
character(len=*), intent(inout)  basis_type,
type(gto_basis_set_type), intent(inout)  gto_basis_set,
type(section_vals_type), optional, pointer  basis_section,
integer  irep,
type(section_vals_type), optional, pointer  dft_section 
)

Read a Gaussian-type orbital (GTO) basis set from the database file.

Parameters
element_symbol...
basis_type...
gto_basis_set...
basis_section...
irep...
dft_section...
Author
MK

Definition at line 1462 of file basis_set_types.F.

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