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root/group/trunk/OOPSE-4/src/UseTheForce/doForces_interface.h
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Comparing trunk/OOPSE-4/src/UseTheForce/doForces_interface.h (file contents):
Revision 2508 by gezelter, Mon Dec 12 19:32:50 2005 UTC vs.
Revision 2917 by chrisfen, Mon Jul 3 13:18:43 2006 UTC

# Line 45 | Line 45
45   #define __C
46   #include "config.h"
47  
48 < #define initFortranFF F90_FUNC(initfortranff, INITFORTRANFF)
49 < #define doForceLoop F90_FUNC(doforceloop, DOFORCELOOP)
50 < #define setFortranElectrostaticMethod F90_FUNC(setfortranelectrostaticmethod, SETFORTRANELECTROSTATICMETHOD)
51 < #define notifyFortranCutoffPolicy F90_FUNC(notifyfortrancutoffpolicy, NOTIFYFORTRANCUTOFFPOLICY)
52 < #define notifyFortranSkinThickness F90_FUNC(notifyfortranskinthickness, NOTIFYFORTRANSKINTHICKNESS)
53 < #define notifyFortranCutoffs F90_FUNC(notifyfortrancutoffs, NOTIFYFORTRANCUTOFFS)
54 < #define notifyFortranYouAreOnYourOwn F90_FUNC(notifyfortranyouareonyourown, NOTIFYFORTRANYOUAREONYOUROWN)
48 > #define initFortranFF FC_FUNC(initfortranff, INITFORTRANFF)
49 > #define doForceLoop FC_FUNC(doforceloop, DOFORCELOOP)
50 > #define getAccumulatedBoxDipole FC_FUNC(getaccumulatedboxdipole, GETACCUMULATEDBOXDIPOLE)
51 > #define setAccumulateBoxDipole FC_FUNC(setaccumulateboxdipole, SETACCUMULATEBOXDIPOLE)
52 > #define setFortranElectrostaticMethod FC_FUNC(setfortranelectrostaticmethod, SETFORTRANELECTROSTATICMETHOD)
53 > #define notifyFortranCutoffPolicy FC_FUNC(notifyfortrancutoffpolicy, NOTIFYFORTRANCUTOFFPOLICY)
54 > #define notifyFortranSkinThickness FC_FUNC(notifyfortranskinthickness, NOTIFYFORTRANSKINTHICKNESS)
55 > #define notifyFortranCutoffs FC_FUNC(notifyfortrancutoffs, NOTIFYFORTRANCUTOFFS)
56 > #define notifyFortranYouAreOnYourOwn FC_FUNC(notifyfortranyouareonyourown, NOTIFYFORTRANYOUAREONYOUROWN)
57  
58   extern "C"{
59    
60    void initFortranFF( int* isError );        
61  
62 <  void doForceLoop( double* positionArray,
63 <                    double* rcArray,
64 <                    double* RotationMatrixArray,
65 <                    double* unitVectorArray_l,
66 <                    double* forceArray,
67 <                    double *torqueArray,
68 <                    double* StressTensor,
69 <                    double* potentialEnergy,
62 >  void doForceLoop( RealType* positionArray,
63 >                    RealType* rcArray,
64 >                    RealType* RotationMatrixArray,
65 >                    RealType* unitVectorArray_l,
66 >                    RealType* forceArray,
67 >                    RealType *torqueArray,
68 >                    RealType* StressTensor,
69 >                    RealType* potentialEnergy,
70                      short int* doPotentialCalc,
71                      short int* doStressCalc,
72                      int* isError );
73  
74 +  void getAccumulatedBoxDipole( RealType* boxDipole );
75 +
76 +  void setAccumulateBoxDipole();
77 +
78    void setFortranElectrostaticMethod( int* electrostaticMethod );
79  
80    void notifyFortranCutoffPolicy( int* cutPolicy );
81  
82 <  void notifyFortranSkinThickness( double *skinThickness );
82 >  void notifyFortranSkinThickness( RealType *skinThickness );
83  
84 <  void notifyFortranCutoffs( double *rCut,
85 <                             double *rSw );
84 >  void notifyFortranCutoffs( RealType *rCut,
85 >                             RealType *rSw );
86  
87    void notifyFortranYouAreOnYourOwn( );
88  

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