618 lines
14 KiB
Fortran
618 lines
14 KiB
Fortran
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!
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!=======================================================================
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!
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MODULE MATERIAL_PROP
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!
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! This module contains input values for the material's properties
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!
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USE ACCURACY_REAL
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!
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IMPLICIT NONE
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!
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REAL (WP) :: RS,MSOM,EPS_B
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!
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CHARACTER (LEN = 5) :: MAT_TYP
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CHARACTER (LEN = 2) :: DMN
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!
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END MODULE MATERIAL_PROP
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!
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!=======================================================================
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!
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MODULE EXT_FIELDS
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!
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! This module contains input values for the external fields
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! (temperature, electric, magnetic)
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!
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USE ACCURACY_REAL
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!
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IMPLICIT NONE
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!
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REAL (WP) :: T,E,H
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!
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CHARACTER (LEN = 2) :: FLD
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!
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END MODULE EXT_FIELDS
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!
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!=======================================================================
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!
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MODULE Q_GRID
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!
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! This module contains input values for q-grid
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!
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USE ACCURACY_REAL
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!
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IMPLICIT NONE
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!
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INTEGER :: N_Q
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!
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REAL (WP) :: Q_MIN,Q_MAX,Q_STEP
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!
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END MODULE Q_GRID
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!
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!=======================================================================
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!
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MODULE E_GRID
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!
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! This module contains input values for energy grid
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!
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USE ACCURACY_REAL
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!
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IMPLICIT NONE
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!
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INTEGER :: N_E
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!
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REAL (WP) :: E_MIN,E_MAX,E_STEP
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!
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END MODULE E_GRID
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!
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!=======================================================================
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!
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MODULE R_GRID
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!
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! This module contains input values for radial grid
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!
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USE ACCURACY_REAL
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!
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IMPLICIT NONE
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!
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INTEGER :: N_R
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!
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REAL (WP) :: R_MIN,R_MAX,R_STEP
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!
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END MODULE R_GRID
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!
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!=======================================================================
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!
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MODULE CONFIN_VAL
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!
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! This module contains the input values for the confinement
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!
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USE ACCURACY_REAL
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!
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IMPLICIT NONE
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!
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REAL (WP) :: R0,L,OM0
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!
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CHARACTER (LEN = 7) :: CONFIN
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!
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END MODULE CONFIN_VAL
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!
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!=======================================================================
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!
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MODULE MULTILAYER
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!
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! This module contains the input values for multilayer systems
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!
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USE ACCURACY_REAL
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!
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IMPLICIT NONE
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!
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REAL (WP) :: DL,D1
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REAL (WP) :: EPS_1,EPS_2
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REAL (WP) :: N_DEP,N_INV
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!
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CHARACTER (LEN = 4) :: H_TYPE
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!
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END MODULE MULTILAYER
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!
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!=======================================================================
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!
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MODULE UNITS
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!
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! This module contains the input values for the units used
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!
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IMPLICIT NONE
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!
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CHARACTER (LEN = 3) :: UNIT
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CHARACTER (LEN = 2) :: UNIK
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!
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END MODULE UNITS
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!
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!=======================================================================
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!
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MODULE SCREENING_TYPE
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!
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! This module contains the input values for the screening type
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!
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IMPLICIT NONE
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!
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CHARACTER (LEN = 2) :: SC_TYPE
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!
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END MODULE SCREENING_TYPE
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!
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!=======================================================================
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!
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MODULE PLASMA
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!
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! This module contains the input values for the plasma type
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!
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!
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USE ACCURACY_REAL
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!
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IMPLICIT NONE
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!
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CHARACTER (LEN = 3) :: PL_TYPE
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!
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REAL (WP) :: ZION,ZION2
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!
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END MODULE PLASMA
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!
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!=======================================================================
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!
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MODULE CALCTYPE
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!
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! This module contains the input values for the calculation type
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!
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!
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USE ACCURACY_REAL
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!
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IMPLICIT NONE
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!
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CHARACTER (LEN = 7) :: CAL_TYPE
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!
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END MODULE CALCTYPE
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!
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!=======================================================================
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!
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MODULE DF_VALUES
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!
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! This module contains the input values for the dielectric
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! function calculation
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!
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USE ACCURACY_REAL
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!
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IMPLICIT NONE
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!
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CHARACTER (LEN = 7) :: ESTDY
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CHARACTER (LEN = 4) :: EPS_T,D_FUNC,NEV_TYPE,MEM_TYPE
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!
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REAL (WP) :: ALPHA,BETA
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!
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INTEGER :: I_T
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!
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END MODULE DF_VALUES
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!
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!=======================================================================
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!
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MODULE PLASMON_DISPERSION
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!
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! This module contains the input values for the analytical
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! plasmon dispersion calculation
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!
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IMPLICIT NONE
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!
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CHARACTER (LEN = 7) :: PL_DISP
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!
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END MODULE PLASMON_DISPERSION
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!
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!=======================================================================
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!
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MODULE LF_VALUES
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!
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! This module contains the input values for the local field
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! corrections calculation
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!
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IMPLICIT NONE
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!
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CHARACTER (LEN = 7) :: GSTDY
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CHARACTER (LEN = 4) :: GQ_TYPE,GQO_TYPE,LANDAU
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CHARACTER (LEN = 3) :: IQ_TYPE
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CHARACTER (LEN = 2) :: G0_TYPE,GI_TYPE
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!
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END MODULE LF_VALUES
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!
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!=======================================================================
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!
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MODULE DAMPING_VALUES
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!
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! This module contains the input values for the plasmon damping calculation
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!
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USE ACCURACY_REAL
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!
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IMPLICIT NONE
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!
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CHARACTER (LEN = 5) :: POWER_1,POWER_2
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CHARACTER (LEN = 4) :: DAMPING,LT_TYPE,DR_TYPE,DC_TYPE,VI_TYPE
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CHARACTER (LEN = 4) :: EE_TYPE,EP_TYPE,EI_TYPE,IP_TYPE,PD_TYPE
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CHARACTER (LEN = 4) :: QD_TYPE
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CHARACTER (LEN = 3) :: RT_TYPE
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!
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REAL (WP) :: ZETA,D_VALUE_1,D_VALUE_2,EK,PCT
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!
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END MODULE DAMPING_VALUES
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!
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!=======================================================================
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!
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MODULE EL_ELE_INTER
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!
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! This module contains the input values for the electron-electron
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! interaction calculation
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!
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USE ACCURACY_REAL
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!
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IMPLICIT NONE
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!
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CHARACTER (LEN = 5) :: INT_POT
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!
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INTEGER :: M,N
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!
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REAL (WP) :: S,EPS,DELTA
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REAL (WP) :: RC,ALF
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REAL (WP) :: A1,A2,A3,A4
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!
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END MODULE EL_ELE_INTER
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!
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!=======================================================================
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!
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MODULE EL_PHO_INTER
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!
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! This module contains the input values for the electron-phonon
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! interaction calculation
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!
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USE ACCURACY_REAL
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!
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IMPLICIT NONE
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!
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REAL (WP) :: EP_C,DEBYE_T
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REAL (WP) :: NA,MA,RA
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!
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END MODULE EL_PHO_INTER
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!
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!=======================================================================
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!
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MODULE EL_IMP_INTER
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!
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! This module contains the input values for the electron-impurity
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! interaction calculation
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!
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USE ACCURACY_REAL
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!
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IMPLICIT NONE
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!
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REAL (WP) :: NI,EI_C
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!
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END MODULE EL_IMP_INTER
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!
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!=======================================================================
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!
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MODULE CLASSICAL_FLUID_VALUES
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!
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! This module contains the input values for the classical
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! fluid parameters
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!
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IMPLICIT NONE
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|
|
!
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CHARACTER (LEN = 3) :: CF_TYPE,PF_TYPE,SL_TYPE
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|
!
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END MODULE CLASSICAL_FLUID_VALUES
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!
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!=======================================================================
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!
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MODULE SF_VALUES
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!
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! This module contains the input values for the structure
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! factor calculation
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!
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IMPLICIT NONE
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|
!
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CHARACTER (LEN = 7) :: SSTDY
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CHARACTER (LEN = 3) :: SQ_TYPE,SQO_TYPE
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|
!
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END MODULE SF_VALUES
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!
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!=======================================================================
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!
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MODULE PC_VALUES
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!
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! This module contains the input values for the pair correlation
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! function calculation
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!
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IMPLICIT NONE
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|
|
!
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CHARACTER (LEN = 4) :: GR0_MODE
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CHARACTER (LEN = 3) :: GR_TYPE
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|
!
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END MODULE PC_VALUES
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!
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!=======================================================================
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!
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MODULE PD_VALUES
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!
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! This module contains the input values for the pair distribution
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! function calculation
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!
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IMPLICIT NONE
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|
|
!
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CHARACTER (LEN = 3) :: RH_TYPE
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|
!
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END MODULE PD_VALUES
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|
|
!
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||
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|
!=======================================================================
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||
|
|
!
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MODULE SPF_VALUES
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|
|
!
|
||
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|
! This module contains the input values for the spectral
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|
|
! function calculation
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||
|
|
!
|
||
|
|
IMPLICIT NONE
|
||
|
|
!
|
||
|
|
CHARACTER (LEN = 4) :: SPF_TYPE
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|
!
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END MODULE SPF_VALUES
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|
|
!
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||
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|
!=======================================================================
|
||
|
|
!
|
||
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|
MODULE ENERGIES
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||
|
|
!
|
||
|
|
! This module contains the input values for the calculation
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||
|
|
! of the different energies
|
||
|
|
!
|
||
|
|
IMPLICIT NONE
|
||
|
|
!
|
||
|
|
CHARACTER (LEN = 6) :: EC_TYPE
|
||
|
|
CHARACTER (LEN = 3) :: EX_TYPE,EK_TYPE
|
||
|
|
CHARACTER (LEN = 2) :: FXC_TYPE,EXC_TYPE
|
||
|
|
!
|
||
|
|
END MODULE ENERGIES
|
||
|
|
!
|
||
|
|
!=======================================================================
|
||
|
|
!
|
||
|
|
MODULE SPIN_POLARIZATION
|
||
|
|
!
|
||
|
|
! This module contains the input values for the spin polarization
|
||
|
|
!
|
||
|
|
USE ACCURACY_REAL
|
||
|
|
!
|
||
|
|
IMPLICIT NONE
|
||
|
|
!
|
||
|
|
INTEGER :: IMODE
|
||
|
|
!
|
||
|
|
REAL (WP) :: XI
|
||
|
|
!
|
||
|
|
END MODULE SPIN_POLARIZATION
|
||
|
|
!
|
||
|
|
!=======================================================================
|
||
|
|
!
|
||
|
|
MODULE THERMO_PROPERTIES
|
||
|
|
!
|
||
|
|
! This module contains the input values for the thermodynamic
|
||
|
|
! properties calculation
|
||
|
|
!
|
||
|
|
IMPLICIT NONE
|
||
|
|
!
|
||
|
|
CHARACTER (LEN = 4) :: TH_PROP
|
||
|
|
CHARACTER (LEN = 3) :: GP_TYPE
|
||
|
|
!
|
||
|
|
END MODULE THERMO_PROPERTIES
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||
|
|
!
|
||
|
|
!=======================================================================
|
||
|
|
!
|
||
|
|
MODULE ELECTRON_MEAN_FREE_PATH
|
||
|
|
!
|
||
|
|
! This module contains the input values for the inelastic
|
||
|
|
! electron mean free path calculation
|
||
|
|
!
|
||
|
|
USE ACCURACY_REAL
|
||
|
|
!
|
||
|
|
IMPLICIT NONE
|
||
|
|
!
|
||
|
|
REAL (WP) :: EK_INI,EK_FIN
|
||
|
|
!
|
||
|
|
END MODULE ELECTRON_MEAN_FREE_PATH
|
||
|
|
!
|
||
|
|
!=======================================================================
|
||
|
|
!
|
||
|
|
MODULE MOMENTS
|
||
|
|
!
|
||
|
|
! This module contains the input values for the calculation
|
||
|
|
! of the moments
|
||
|
|
!
|
||
|
|
USE ACCURACY_REAL
|
||
|
|
!
|
||
|
|
IMPLICIT NONE
|
||
|
|
!
|
||
|
|
CHARACTER (LEN = 3) :: M_TYPE
|
||
|
|
!
|
||
|
|
INTEGER :: N_M
|
||
|
|
!
|
||
|
|
END MODULE MOMENTS
|
||
|
|
!
|
||
|
|
!=======================================================================
|
||
|
|
!
|
||
|
|
MODULE ION_BEAM
|
||
|
|
!
|
||
|
|
! This module contains the input values for the incoming ion beam
|
||
|
|
!
|
||
|
|
USE ACCURACY_REAL
|
||
|
|
!
|
||
|
|
IMPLICIT NONE
|
||
|
|
!
|
||
|
|
REAL (WP) :: Z_BEAM,EK_BEAM
|
||
|
|
!
|
||
|
|
!
|
||
|
|
END MODULE ION_BEAM
|
||
|
|
!
|
||
|
|
!=======================================================================
|
||
|
|
!
|
||
|
|
MODULE OUT_VALUES_1
|
||
|
|
!
|
||
|
|
! This module contains input values for print switches
|
||
|
|
!
|
||
|
|
IMPLICIT NONE
|
||
|
|
!
|
||
|
|
INTEGER :: I_DF,I_PZ,I_SU,I_CD
|
||
|
|
!
|
||
|
|
END MODULE OUT_VALUES_1
|
||
|
|
!
|
||
|
|
!=======================================================================
|
||
|
|
!
|
||
|
|
MODULE OUT_VALUES_2
|
||
|
|
!
|
||
|
|
! This module contains input values for print switches
|
||
|
|
!
|
||
|
|
IMPLICIT NONE
|
||
|
|
!
|
||
|
|
INTEGER :: I_PD,I_EH,I_E2,I_CK
|
||
|
|
INTEGER :: I_CR,I_PK
|
||
|
|
!
|
||
|
|
END MODULE OUT_VALUES_2
|
||
|
|
!
|
||
|
|
!=======================================================================
|
||
|
|
!
|
||
|
|
MODULE OUT_VALUES_3
|
||
|
|
!
|
||
|
|
! This module contains input values for print switches
|
||
|
|
!
|
||
|
|
IMPLICIT NONE
|
||
|
|
!
|
||
|
|
INTEGER :: I_LF,I_IQ,I_SF,I_PC
|
||
|
|
INTEGER :: I_P2
|
||
|
|
INTEGER :: I_VX,I_DC,I_MD,I_LD
|
||
|
|
INTEGER :: I_DP,I_LT,I_BR,I_PE
|
||
|
|
INTEGER :: I_QC,I_RL,I_KS,I_OQ
|
||
|
|
INTEGER :: I_ME,I_MS,I_ML,I_MC
|
||
|
|
INTEGER :: I_DE,I_ZE,I_SR,I_CW
|
||
|
|
INTEGER :: I_CF,I_EM,I_MF,I_SP
|
||
|
|
INTEGER :: I_SE,I_SB,I_ES,I_GR
|
||
|
|
INTEGER :: I_FD,I_BE,I_MX
|
||
|
|
INTEGER :: I_SC,I_DS,I_NV,I_MT
|
||
|
|
!
|
||
|
|
END MODULE OUT_VALUES_3
|
||
|
|
!
|
||
|
|
!=======================================================================
|
||
|
|
!
|
||
|
|
MODULE OUT_VALUES_4
|
||
|
|
!
|
||
|
|
! This module contains input values for print switches
|
||
|
|
!
|
||
|
|
IMPLICIT NONE
|
||
|
|
!
|
||
|
|
INTEGER :: I_GP,I_PR,I_CO,I_CP
|
||
|
|
INTEGER :: I_BM,I_SH,I_S0,I_S1
|
||
|
|
INTEGER :: I_DT,I_PS,I_IE,I_EI
|
||
|
|
INTEGER :: I_FH,I_EY
|
||
|
|
!
|
||
|
|
END MODULE OUT_VALUES_4
|
||
|
|
!
|
||
|
|
!=======================================================================
|
||
|
|
!
|
||
|
|
MODULE OUT_VALUES_5
|
||
|
|
!
|
||
|
|
! This module contains input values for print switches
|
||
|
|
!
|
||
|
|
IMPLICIT NONE
|
||
|
|
!
|
||
|
|
INTEGER :: I_EF,I_KF,I_VF,I_TE,I_DL
|
||
|
|
!
|
||
|
|
END MODULE OUT_VALUES_5
|
||
|
|
!
|
||
|
|
!=======================================================================
|
||
|
|
!
|
||
|
|
MODULE OUT_VALUES_6
|
||
|
|
!
|
||
|
|
! This module contains input values for print switches
|
||
|
|
!
|
||
|
|
IMPLICIT NONE
|
||
|
|
!
|
||
|
|
INTEGER :: I_TW,I_VT,I_TC
|
||
|
|
!
|
||
|
|
END MODULE OUT_VALUES_6
|
||
|
|
!
|
||
|
|
!=======================================================================
|
||
|
|
!
|
||
|
|
MODULE OUT_VALUES_7
|
||
|
|
!
|
||
|
|
! This module contains input values for print switches
|
||
|
|
!
|
||
|
|
IMPLICIT NONE
|
||
|
|
!
|
||
|
|
INTEGER :: I_EG,I_EX,I_XC,I_EC
|
||
|
|
INTEGER :: I_HF,I_EK,I_EP
|
||
|
|
!
|
||
|
|
END MODULE OUT_VALUES_7
|
||
|
|
!
|
||
|
|
!=======================================================================
|
||
|
|
!
|
||
|
|
MODULE OUT_VALUES_8
|
||
|
|
!
|
||
|
|
! This module contains input values for print switches
|
||
|
|
!
|
||
|
|
IMPLICIT NONE
|
||
|
|
!
|
||
|
|
INTEGER :: I_VI,I_DI
|
||
|
|
!
|
||
|
|
END MODULE OUT_VALUES_8
|
||
|
|
!
|
||
|
|
!=======================================================================
|
||
|
|
!
|
||
|
|
MODULE OUT_VALUES_9
|
||
|
|
!
|
||
|
|
! This module contains input values for print switches
|
||
|
|
!
|
||
|
|
IMPLICIT NONE
|
||
|
|
!
|
||
|
|
INTEGER :: I_EL,I_PO,I_RF
|
||
|
|
INTEGER :: I_VC
|
||
|
|
!
|
||
|
|
END MODULE OUT_VALUES_9
|
||
|
|
!
|
||
|
|
!=======================================================================
|
||
|
|
!
|
||
|
|
MODULE OUT_VALUES_10
|
||
|
|
!
|
||
|
|
! This module contains input values for print switches
|
||
|
|
!
|
||
|
|
IMPLICIT NONE
|
||
|
|
!
|
||
|
|
INTEGER :: I_FN,I_WR,I_TI
|
||
|
|
!
|
||
|
|
END MODULE OUT_VALUES_10
|
||
|
|
!
|
||
|
|
!=======================================================================
|
||
|
|
!
|
||
|
|
MODULE OUT_VALUES_P
|
||
|
|
!
|
||
|
|
! This module contains input values for print switches
|
||
|
|
!
|
||
|
|
IMPLICIT NONE
|
||
|
|
!
|
||
|
|
INTEGER :: I_FP
|
||
|
|
!
|
||
|
|
END MODULE OUT_VALUES_P
|
||
|
|
!
|
||
|
|
!=======================================================================
|
||
|
|
!
|
||
|
|
MODULE OUT_CALC
|
||
|
|
!
|
||
|
|
! This module contains input values for the calculators
|
||
|
|
!
|
||
|
|
IMPLICIT NONE
|
||
|
|
!
|
||
|
|
INTEGER :: I_C1,I_C2,I_C3,I_C4,I_C5
|
||
|
|
INTEGER :: I_C6,I_C7,I_C8,I_C9,I_PP
|
||
|
|
!
|
||
|
|
END MODULE OUT_CALC
|
||
|
|
!
|
||
|
|
!=======================================================================
|
||
|
|
!
|