memset(moldyn,0,sizeof(t_moldyn));
+ moldyn->argc=argc;
+ moldyn->args=argv;
+
rand_init(&(moldyn->random),NULL,1);
moldyn->random.status|=RAND_STAT_VERBOSE;
printf("\rsched:%d, steps:%d, T:%3.1f/%3.1f P:%4.1f/%4.1f V:%6.1f",
sched->count,i,
moldyn->t,moldyn->t_avg,
- moldyn->p_avg/BAR,moldyn->p/BAR,
+ moldyn->p_avg/BAR,moldyn->gp_avg/BAR,
moldyn->volume);
fflush(stdout);
}