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Searched refs:fixedG_list (Results 1 – 3 of 3) sorted by relevance

/dports/science/qmcpack/qmcpack-3.11.0/src/QMCWaveFunctions/tests/
H A Dtest_TrialWaveFunction_He.cpp258 auto fixedG_list = convertUPtrToRefVector(fixedG_list_ptr); variable
261 …unction::mw_evaluateDeltaLogSetup(wf_list, p_list, logpsi_fixed_list, logpsi_opt_list, fixedG_list,
279 CHECK(fixedG1[0][0] == ValueApprox(fixedG_list[0].get()[0][0]));
280 CHECK(fixedG1[0][1] == ValueApprox(fixedG_list[0].get()[0][1]));
281 CHECK(fixedG1[0][2] == ValueApprox(fixedG_list[0].get()[0][2]));
282 CHECK(fixedG1[1][0] == ValueApprox(fixedG_list[0].get()[1][0]));
283 CHECK(fixedG1[1][1] == ValueApprox(fixedG_list[0].get()[1][1]));
284 CHECK(fixedG1[1][2] == ValueApprox(fixedG_list[0].get()[1][2]));
308 fixedG_list.push_back(G2);
/dports/science/qmcpack/qmcpack-3.11.0/src/QMCWaveFunctions/
H A DTrialWaveFunction.cpp283 … RefVector<ParticleSet::ParticleGradient_t>& fixedG_list, in mw_evaluateDeltaLogSetup() argument
319 wavefunction_components[i]->mw_evaluateLog(wfc_list, p_list, fixedG_list, fixedL_list); in mw_evaluateDeltaLogSetup()
333 addAndCopyToP(p_list[iw], wf_list[iw], fixedG_list[iw], fixedL_list[iw]); in mw_evaluateDeltaLogSetup()
H A DTrialWaveFunction.h223 RefVector<ParticleSet::ParticleGradient_t>& fixedG_list,