UseTheForce/DarkSide/fElectrostaticSummationMethod.h

#ifdef __OPENMD_C
#ifndef __FELECTROSTATICSUMMATIONMETHOD
#define __FELECTROSTATICSUMMATIONMETHOD

#define NONE                   1
#define SWITCHING_FUNCTION     2
#define SHIFTED_POTENTIAL      3
#define SHIFTED_FORCE          4
#define REACTION_FIELD         5
/* Ewald methods aren't supported yet */
#define EWALD_FULL             6 
#define EWALD_PME              7
#define EWALD_SPME             8

#endif
#endif /*__OPENMD_C*/

#ifdef  __FORTRAN90

  INTEGER, PARAMETER:: NONE                      = 1
  INTEGER, PARAMETER:: SWITCHING_FUNCTION        = 2
  INTEGER, PARAMETER:: SHIFTED_POTENTIAL         = 3
  INTEGER, PARAMETER:: SHIFTED_FORCE             = 4
  INTEGER, PARAMETER:: REACTION_FIELD            = 5
  INTEGER, PARAMETER:: EWALD_FULL                = 6
  INTEGER, PARAMETER:: EWALD_PME                 = 7
  INTEGER, PARAMETER:: EWALD_SPME                = 8

#endif
Revision:	1465
Committed:	Fri Jul 9 23:08:25 2010 UTC (14 years, 10 months ago) by chuckv
Content type:	text/plain
File size:	889 byte(s)
Log Message:	Creating busticated version of OpenMD
#	Content
1	#ifdef __OPENMD_C
2	#ifndef __FELECTROSTATICSUMMATIONMETHOD
3	#define __FELECTROSTATICSUMMATIONMETHOD
4
5	#define NONE 1
6	#define SWITCHING_FUNCTION 2
7	#define SHIFTED_POTENTIAL 3
8	#define SHIFTED_FORCE 4
9	#define REACTION_FIELD 5
10	/* Ewald methods aren't supported yet */
11	#define EWALD_FULL 6
12	#define EWALD_PME 7
13	#define EWALD_SPME 8
14
15	#endif
16	#endif /__OPENMD_C/
17
18	#ifdef __FORTRAN90
19
20	INTEGER, PARAMETER:: NONE = 1
21	INTEGER, PARAMETER:: SWITCHING_FUNCTION = 2
22	INTEGER, PARAMETER:: SHIFTED_POTENTIAL = 3
23	INTEGER, PARAMETER:: SHIFTED_FORCE = 4
24	INTEGER, PARAMETER:: REACTION_FIELD = 5
25	INTEGER, PARAMETER:: EWALD_FULL = 6
26	INTEGER, PARAMETER:: EWALD_PME = 7
27	INTEGER, PARAMETER:: EWALD_SPME = 8
28
29	#endif