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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5520 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp
2011-01-11 00:41:00 +00:00
parent 4bc2d6f332
commit 82ec94916d
79 changed files with 458 additions and 315 deletions
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5
src/min_fire.cpp
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@ -81,15 +81,16 @@ void MinFire::reset_vectors()
int MinFire::iterate(int maxiter)
{
int ntimestep,flag,flagall;
bigint ntimestep;
double vmax,vdotf,vdotfall,vdotv,vdotvall,fdotf,fdotfall;
double scale1,scale2;
double dtvone,dtv,dtfm;
int flag,flagall;
alpha_final = 0.0;
double alpha = ALPHA0;
double dtmax = TMAX * dt;
int last_negative = update->ntimestep;
bigint last_negative = update->ntimestep;
for (int iter = 0; iter < maxiter; iter++) {
ntimestep = ++update->ntimestep;