xmolecule
Manual
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xmolecule_get_nao_conf
Subroutine
Gnu General Public License V3
20 statements
xmolecule_interface
xmolecule_get_nao_conf
Contents
public subroutine xmolecule_get_nao_conf(xdata_cptr, nao_conf_string, l_atom) bind(c)
returns numerical atomic orbital configuration string
Arguments
Type
Intent
Optional
Attributes
Name
type(c_ptr),
intent(inout)
::
xdata_cptr
character(len=c_char),
intent(inout)
::
nao_conf_string
(l_atom*512)
integer(kind=c_int),
intent(in)
::
l_atom