| 113 | 
  | 
  int    getUseInitXSstate( void )  { return useInitXSstate; } | 
| 114 | 
  | 
  double getOrthoBoxTolerance(void) { return orthoBoxTolerance; } | 
| 115 | 
  | 
  int    getPBC( void )             { return usePBC; } | 
| 116 | 
– | 
  int    getUseRF( void )           { return useRF; } | 
| 116 | 
  | 
  char*  getMixingRule( void)       { return mixingRule; } | 
| 117 | 
  | 
  double getZconsTime(void)         { return zcons_time; } | 
| 118 | 
  | 
  double getZconsTol(void)          { return zcons_tol; } | 
| 140 | 
  | 
  double getOmegaSpringConst(void)  { return therm_int_omega_spring; } | 
| 141 | 
  | 
  double getSurfaceTension(void)    { return surface_tension; } | 
| 142 | 
  | 
  bool   getPrintPressureTensor(void) { return print_pressure_tensor;} | 
| 143 | 
< | 
  char*  getCoulombicCorrection(void) { return coulombicCorrection; } | 
| 143 | 
> | 
  char*  getElectrostaticSummationMethod(void) { return electrostaticSummationMethod; } | 
| 144 | 
  | 
  double getDampingAlpha(void)      { return dampingAlpha; } | 
| 145 | 
  | 
  char*  getCutoffPolicy(void)      { return cutoffPolicy; } | 
| 146 | 
  | 
   | 
| 193 | 
  | 
  short int haveOmegaSpringConst(void)   { return have_omega_spring_constant; } | 
| 194 | 
  | 
  short int haveSurfaceTension(void)     { return have_surface_tension; } | 
| 195 | 
  | 
  short int havePrintPressureTensor(void) {return have_print_pressure_tensor;} | 
| 196 | 
< | 
  short int haveCoulombicCorrection(void) {return have_coulombic_correction;} | 
| 196 | 
> | 
  short int haveElectrostaticSummationMethod(void) {return have_electro_sum_method;} | 
| 197 | 
  | 
  short int haveDampingAlpha(void)       { return have_damping_alpha; } | 
| 198 | 
  | 
  short int haveCutoffPolicy(void)       { return have_cutoff_policy; } | 
| 199 | 
  | 
 | 
| 243 | 
  | 
  int useInitTime; | 
| 244 | 
  | 
  int useInitXSstate; | 
| 245 | 
  | 
  int usePBC; | 
| 247 | 
– | 
  int useRF; | 
| 246 | 
  | 
  double q_mass; | 
| 247 | 
  | 
  double tau_thermostat; | 
| 248 | 
  | 
  double tau_barostat; | 
| 273 | 
  | 
  double therm_int_omega_spring; | 
| 274 | 
  | 
  double surface_tension; | 
| 275 | 
  | 
  bool print_pressure_tensor; | 
| 276 | 
< | 
  char coulombicCorrection[100]; | 
| 276 | 
> | 
  char electrostaticSummationMethod[100]; | 
| 277 | 
  | 
  double dampingAlpha; | 
| 278 | 
  | 
  char cutoffPolicy[100]; | 
| 279 | 
  | 
   | 
| 305 | 
  | 
  short int have_omega_spring_constant; | 
| 306 | 
  | 
  short int have_surface_tension; | 
| 307 | 
  | 
  short int have_print_pressure_tensor; | 
| 308 | 
< | 
  short int have_coulombic_correction; | 
| 308 | 
> | 
  short int have_electro_sum_method; | 
| 309 | 
  | 
  short int have_damping_alpha; | 
| 310 | 
  | 
  short int have_cutoff_policy; | 
| 311 | 
  | 
}; |