qp2/src/mol_properties/properties.irp.f

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program mol_properties

  implicit none

  BEGIN_DOC
  ! Calculation of the properties
  END_DOC

  read_wf = .True.
  touch read_wf

  call print_mol_properties()

end
add molecular properties 2023-03-11 22:31:57 +01:00			`program mol_properties`

			`implicit none`

			`BEGIN_DOC`
clean 2023-03-11 23:40:52 +01:00			`! Calculation of the properties`
add molecular properties 2023-03-11 22:31:57 +01:00			`END_DOC`

			`read_wf = .True.`
			`touch read_wf`

			`call print_mol_properties()`

			`end`