| # | Line 386 | Line 386 | namespace OpenMD { | |
|---|---|---|
| 386 | } | |
| 387 | ||
| 388 | // Zero out the stress tensor | |
| 389 | < | tau = Mat3x3d(0.0); |
| 389 | > | tau *= 0.0; |
| 390 | ||
| 391 | } | |
| 392 | ||
| # | Line 651 | Line 651 | namespace OpenMD { | |
| 651 | fDecomp_->unpackInteractionData(idat, atom1, atom2); | |
| 652 | vij += vpair; | |
| 653 | fij += f1; | |
| 654 | + | cerr << "ats = " << atom1 << " " << atom2 << "d = " << *(idat.d) << " f1 = " << f1 << "\n"; |
| 655 | tau -= outProduct( *(idat.d), f1); | |
| 656 | } | |
| 657 | } | |
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