72 |
|
char* getZconsForcePolicy(void) { return zconsForcePolicy;} |
73 |
|
double getZconsGap(void) {return zcons_gap;} |
74 |
|
double getZconsFixtime(void) {return zcons_fixtime;} |
75 |
+ |
int getZconsUsingSMD(void) {return zcons_using_smd;} |
76 |
|
|
77 |
|
int getSeed(void) { return seed;} |
78 |
|
double getLJrcut(void) { return LJrcut;} |
113 |
|
short int haveZconsForcePolicy(void){ return have_zcons_force_policy;} |
114 |
|
short int haveZConsGap(void) {return have_zcons_gap;} |
115 |
|
short int haveZConsFixTime(void) {return have_zcons_fixtime;} |
116 |
+ |
short int haveZConsUsingSMD(void) {return have_zcons_using_smd;} |
117 |
|
|
118 |
|
short int haveSeed(void) { return have_seed;} |
119 |
|
short int haveLJrcut(void) { return have_ljrcut;} |
181 |
|
char zconsForcePolicy[100]; |
182 |
|
double zcons_gap; |
183 |
|
double zcons_fixtime; |
184 |
+ |
int zcons_using_smd; |
185 |
|
|
186 |
|
int seed; |
187 |
|
double LJrcut; |
207 |
|
short int have_zcons_tol, have_seed, have_ljrcut; |
208 |
|
short int have_zcons_force_policy, have_reset_time; |
209 |
|
short int have_zcons_gap, have_zcons_fixtime; |
210 |
+ |
short int have_zcons_using_smd; |
211 |
|
short int have_minimizer, have_minimizer_maxiteration; |
212 |
|
short int have_minimizer_writefrq, have_minimizer_stepsize; |
213 |
|
short int have_minimizer_ftol, have_minimizer_gtol; |