Révision 8 src/egrad_mopac.f90

egrad_mopac.f90 (revision 8)
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  ! This routines calculates the energy and the gradient of 
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  ! a molecule, using mopac 
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  use Path_module, only : Nat, renum,Order,OrderInv,AtName, Coord, dzdc, indzmat,Nom,Atome, massat, unit,ProgExe, au2kcal
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  use Path_module, only : Nat, renum,Order,OrderInv,AtName, Coord, ProgExe
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  use Io_module
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  IMPLICIT NONE

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