don't use doubles as boolean
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@ -232,7 +232,7 @@ void ComputeDisplaceAtom::refresh()
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int nlocal = atom->nlocal;
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int nlocal = atom->nlocal;
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for (int i = 0; i < nlocal; i++)
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for (int i = 0; i < nlocal; i++)
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if (varatom[i]) domain->unmap(x[i],image[i],xoriginal[i]);
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if (varatom[i] != 0.0) domain->unmap(x[i],image[i],xoriginal[i]);
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}
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}
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/* ----------------------------------------------------------------------
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/* ----------------------------------------------------------------------
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@ -441,7 +441,7 @@ void Finish::end(int flag)
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double fraction,flop3,flop1;
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double fraction,flop3,flop1;
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if (nsteps) {
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if (nsteps) {
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if (time_kspace) fraction = time3d/time_kspace*100.0;
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if (time_kspace != 0.0) fraction = time3d/time_kspace*100.0;
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else fraction = 0.0;
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else fraction = 0.0;
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flop3 = nfft*nflops/1.0e9/(time3d/nsteps);
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flop3 = nfft*nflops/1.0e9/(time3d/nsteps);
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flop1 = nfft*nflops/1.0e9/(time1d/nsteps);
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flop1 = nfft*nflops/1.0e9/(time1d/nsteps);
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