/home/eoseret/qaas_runs_CPU_9468/171-148-3214/intel/CoMD/build/CoMD/CoMD/src-openmp/initAtoms.c: 123 - 133
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123:    #pragma omp parallel for
124:    for (int iBox=0; iBox<s->boxes->nLocalBoxes; ++iBox)
125:    {
126:       for (int iOff=MAXATOMS*iBox, ii=0; ii<s->boxes->nAtoms[iBox]; ++ii, ++iOff)
127:       {
128:          int iSpecies = s->atoms->iSpecies[iOff];
129:          real_t mass = s->species[iSpecies].mass;
130: 
131:          s->atoms->p[iOff][0] += mass * vShift[0];
132:          s->atoms->p[iOff][1] += mass * vShift[1];
133:          s->atoms->p[iOff][2] += mass * vShift[2];
