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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2589 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp
2009-02-12 21:36:52 +00:00
parent 0b60bfbf51
commit 94ddc19477
39 changed files with 1506 additions and 1426 deletions
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12
src/velocity.cpp
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@ -225,8 +225,8 @@ void Velocity::create(int narg, char **arg)
m = atom->map(i);
if (m >= 0 && m < nlocal) {
if (mask[m] & groupbit) {
if (mass) factor = 1.0/sqrt(mass[type[m]]);
else factor = 1.0/sqrt(rmass[m]);
if (rmass) factor = 1.0/sqrt(rmass[m]);
factor = 1.0/sqrt(mass[type[m]]);
v[m][0] = vx * factor;
v[m][1] = vy * factor;
if (dimension == 3) v[m][2] = vz * factor;
@ -257,8 +257,8 @@ void Velocity::create(int narg, char **arg)
vy = random->gaussian();
vz = random->gaussian();
}
if (mass) factor = 1.0/sqrt(mass[type[i]]);
else factor = 1.0/sqrt(rmass[i]);
if (rmass) factor = 1.0/sqrt(rmass[i]);
factor = 1.0/sqrt(mass[type[i]]);
v[i][0] = vx * factor;
v[i][1] = vy * factor;
if (dimension == 3) v[i][2] = vz * factor;
@ -283,8 +283,8 @@ void Velocity::create(int narg, char **arg)
vz = random->gaussian();
}
if (mass) factor = 1.0/sqrt(mass[type[i]]);
else factor = 1.0/sqrt(rmass[i]);
if (rmass) factor = 1.0/sqrt(rmass[i]);
factor = 1.0/sqrt(mass[type[i]]);
v[i][0] = vx * factor;
v[i][1] = vy * factor;
if (dimension == 3) v[i][2] = vz * factor;