Revision 5 src/Path_module.f90

Path_module.f90 (revision 5)
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  INTEGER(KINT) :: MaxCyc
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  REAL(KREAL) :: SThresh, Smax, SthreshRms
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  REAL(KREAL) :: GThresh, GThreshRMS
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! Name of the file to print geometries and their energies
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  CHARACTER(LCHARS) :: GeomFile
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! Flag to decide if we print something in GeomFile
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  LOGICAL :: FPrintGeom
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! Number of steps in memory for Step_RFO_all
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  INTEGER(KINT) :: NGintMax = 10
......
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  CHARACTER(SCHARS) :: Step_method='RFO'
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  CHARACTER(SCHARS) :: Prog="GAUSSIAN"
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  CHARACTER(VLCHARS) :: ProgExe="g03"
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! Input: format of the geometry input 
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! PFL 2013/02: This name is dumb ! I should have used GeomFormat ! => To DO!!
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  CHARACTER(SCHARS) :: Input
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! Poscar: is the name to use for POSCAR files for VASP
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  CHARACTER(SCHARS) :: Poscar
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! PFL 06/2011: HesUpd is deprecated
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! I replace it by HUpdate that is more intuitive to me

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