/beegfs/hackathon/users/eoseret/qaas_runs_test/178-654-5599/intel/miniqmc/build/miniqmc/src/Numerics/OhmmsPETE/TinyVector.h: 169 - 169
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169:   inline Type_t& operator[](unsigned int i) { return X[i]; }
/beegfs/hackathon/users/eoseret/qaas_runs_test/178-654-5599/intel/miniqmc/build/miniqmc/src/Numerics/OhmmsPETE/VectorSoAContainer.h: 273 - 273
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273:   inline const T* restrict data(size_t i) const { return myData + i * nGhosts; }
/beegfs/hackathon/users/eoseret/qaas_runs_test/178-654-5599/intel/miniqmc/build/miniqmc/src/Numerics/PETE/OperatorTags.h: 94 - 94
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94:     (const_cast<T1&>(a) += b);
/usr/lib/gcc/x86_64-redhat-linux/11/../../../../include/c++/11/bits/stl_numeric.h: 140 - 141
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/usr/lib/gcc/x86_64-redhat-linux/11/../../../../include/c++/11/bits/stl_vector.h: 1169 - 1169
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/beegfs/hackathon/users/eoseret/qaas_runs_test/178-654-5599/intel/miniqmc/build/miniqmc/src/Numerics/OhmmsPETE/OhmmsVector.h: 223 - 249
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223:     return X[i];
[...]
249:   inline const_pointer data() const { return X; }
/usr/lib/gcc/x86_64-redhat-linux/11/../../../../include/c++/11/bits/stl_iterator.h: 1028 - 1028
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/usr/lib/gcc/x86_64-redhat-linux/11/../../../../include/c++/11/bits/stl_iterator.h: 1182 - 1182
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/beegfs/hackathon/users/eoseret/qaas_runs_test/178-654-5599/intel/miniqmc/build/miniqmc/src/QMCWaveFunctions/Jastrow/OneBodyJastrowRef.h: 186 - 263
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186:     for (int jat = 0; jat < Nions; ++jat)
187:       lap += d2u[jat] + lapfac * du[jat];
188:     for (int idim = 0; idim < OHMMS_DIM; ++idim)
189:     {
190:       const valT* restrict dX = displ.data(idim);
191:       valT s                  = valT();
192:       for (int jat = 0; jat < Nions; ++jat)
193:         s += du[jat] * dX[jat];
194:       grad[idim] = s;
[...]
256:   {
257:     UpdateMode = ORB_PBYP_PARTIAL;
258: 
259:     computeU3(P, iat, P.getDistTableAB(myTableID).getTempDists().data());
260:     curLap = accumulateGL(dU.data(), d2U.data(), P.getDistTableAB(myTableID).getTempDispls(), curGrad);
261:     curAt  = std::accumulate(U.begin(), U.begin() + Nions, valT());
262:     grad_iat += curGrad;
263:     return std::exp(Vat[iat] - curAt);
