xmolecule
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get_atomic_species
Subroutine
Gnu General Public License V3
43 statements
atom
get_atomic_species
Contents
public subroutine get_atomic_species(s, charge, mass)
returns charge and mass of a given element
Arguments
Type
Intent
Optional
Attributes
Name
character(len=*),
intent(in)
::
s
integer,
intent(out)
::
charge
real(kind=long),
intent(out)
::
mass