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root/OpenMD/trunk/src/nonbonded/Electrostatic.cpp
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Comparing trunk/src/nonbonded/Electrostatic.cpp (file contents):
Revision 1933 by gezelter, Fri Aug 23 15:59:23 2013 UTC vs.
Revision 1934 by gezelter, Mon Aug 26 14:15:09 2013 UTC

# Line 1440 | Line 1440 | namespace OpenMD {
1440                    Q = atom->getQuadrupole() * mPoleConverter;
1441                    Qk = Q * kVec;                  
1442                    qk = dot(kVec, Qk);
1443 <                  qxk[i] = cross(kVec, Qk);
1443 >                  qxk[i] = -cross(kVec, Qk);
1444                    qkc[i] = qk * ckr[i];
1445                    qks[i] = qk * skr[i];
1446                  }              

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