include/tables.h

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  35
  36 #ifndef _tables_h
  37 #define _tables_h
  38
  39
  40 #ifdef __cplusplus
  41 extern "C" {
  42 #endif
  43
  44
  45 void table_spline3_fill_ewald_lr(real *tabf,real *tabv,
  46                                  int ntab,int tableformat,
  47                                  real dr,real beta);
  48 /* Fill table tabf of size ntab with spacing dr with the ewald long-range
  49  * (mesh) force and with tableformatF and tabv!=NULL, fill tabv energy.
  50  * With tableformatFDV0 the size of the tabf array should be ntab*4, tabv=NULL.
  51  * This function interpolates the Ewald mesh potential contribution
  52  * with coefficient beta using a quadratic spline.
  53  * The force can then be interpolated linearly.
  54  */
  55
  56 real ewald_spline3_table_scale(real ewaldcoeff,real rc);
  57 /* Return the scaling for the Ewald quadratic spline tables. */
  58
  59
  60 #ifdef __cplusplus
  61 }
  62 #endif
  63
  64 #endif  /* _tables\_h */