Searched refs:d2psi_v_list (Results 1 – 10 of 10) sorted by relevance
/dports/science/qmcpack/qmcpack-3.11.0/src/QMCWaveFunctions/BsplineFactory/ |
H A D | BsplineSet.h | 159 RefVector<ValueVector_t> d2psi_v_list; in mw_evaluate_notranspose() local 165 d2psi_v_list.reserve(nw); in mw_evaluate_notranspose() 174 d2psi_v_list.clear(); in mw_evaluate_notranspose() 183 d2psi_v_list.push_back(mw_d2psi_v.back()); in mw_evaluate_notranspose() 186 mw_evaluateVGL(spo_list, P_list, iat, psi_v_list, dpsi_v_list, d2psi_v_list); in mw_evaluate_notranspose()
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H A D | SplineC2COMPTarget.h | 103 const RefVector<ValueVector_t>& d2psi_v_list) const; 276 const RefVector<ValueVector_t>& d2psi_v_list) const override;
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H A D | SplineC2ROMPTarget.h | 105 const RefVector<ValueVector_t>& d2psi_v_list) const; 284 const RefVector<ValueVector_t>& d2psi_v_list) const override;
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H A D | SplineC2COMPTarget.cpp | 571 const RefVector<ValueVector_t>& d2psi_v_list) const in evaluateVGLMultiPos() 640 ValueVector_t& d2psi_v(d2psi_v_list[iw]); in evaluateVGLMultiPos() 658 const RefVector<ValueVector_t>& d2psi_v_list) const in mw_evaluateVGL() 691 d2psi_v_list); in mw_evaluateVGL() 1261 RefVector<ValueVector_t> d2psi_v_list; in evaluate_notranspose() local 1268 d2psi_v_list.reserve(block_size); in evaluate_notranspose() 1279 d2psi_v_list.clear(); in evaluate_notranspose() 1299 d2psi_v_list.push_back(multi_d2psi_v[ipos]); in evaluate_notranspose() 1302 …LMultiPos(multi_pos_copy, offload_scratch, results_scratch, psi_v_list, dpsi_v_list, d2psi_v_list); in evaluate_notranspose()
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H A D | SplineC2ROMPTarget.cpp | 713 const RefVector<ValueVector_t>& d2psi_v_list) const in evaluateVGLMultiPos() 783 ValueVector_t& d2psi_v(d2psi_v_list[iw]); in evaluateVGLMultiPos() 801 const RefVector<ValueVector_t>& d2psi_v_list) const in mw_evaluateVGL() 834 d2psi_v_list); in mw_evaluateVGL() 1757 RefVector<ValueVector_t> d2psi_v_list; in evaluate_notranspose() local 1764 d2psi_v_list.reserve(block_size); in evaluate_notranspose() 1775 d2psi_v_list.clear(); in evaluate_notranspose() 1795 d2psi_v_list.push_back(multi_d2psi_v[ipos]); in evaluate_notranspose() 1798 …LMultiPos(multi_pos_copy, offload_scratch, results_scratch, psi_v_list, dpsi_v_list, d2psi_v_list); in evaluate_notranspose()
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/dports/science/qmcpack/qmcpack-3.11.0/src/QMCWaveFunctions/tests/ |
H A D | test_hybridrep.cpp | 357 RefVector<SPOSet::ValueVector_t> d2psi_v_list; variable 363 d2psi_v_list.push_back(d2psi); 364 d2psi_v_list.push_back(d2psi_2); 366 spo->mw_evaluateVGL(spo_list, P_list, 0, psi_v_list, dpsi_v_list, d2psi_v_list); 382 REQUIRE(std::real(d2psi_v_list[1].get()[0]) == Approx(-1.3757134676)); 383 REQUIRE(std::real(d2psi_v_list[1].get()[1]) == Approx(-2.4803137779)); 399 REQUIRE(std::imag(d2psi_v_list[1].get()[0]) == Approx(-1.3757134676)); 400 REQUIRE(std::imag(d2psi_v_list[1].get()[1]) == Approx(-2.4919104576));
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H A D | test_einset.cpp | 382 RefVector<SPOSet::ValueVector_t> d2psi_v_list; variable 388 d2psi_v_list.push_back(d2psi); 389 d2psi_v_list.push_back(d2psi_2); 391 spo->mw_evaluateVGL(spo_list, p_list, 0, psi_v_list, dpsi_v_list, d2psi_v_list); 407 REQUIRE(std::real(d2psi_v_list[1].get()[0]) == Approx(-1.3757134676)); 408 REQUIRE(std::real(d2psi_v_list[1].get()[1]) == Approx(-2.4803137779)); 424 REQUIRE(std::imag(d2psi_v_list[1].get()[0]) == Approx(-1.3757134676)); 425 REQUIRE(std::imag(d2psi_v_list[1].get()[1]) == Approx(-2.4919104576));
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/dports/science/qmcpack/qmcpack-3.11.0/src/QMCWaveFunctions/ |
H A D | SPOSet.cpp | 78 const RefVector<ValueVector_t>& d2psi_v_list) const in mw_evaluateVGL() 83 spo_list[iw].evaluateVGL(P_list[iw], iat, psi_v_list[iw], dpsi_v_list[iw], d2psi_v_list[iw]); in mw_evaluateVGL()
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H A D | SPOSet.h | 265 const RefVector<ValueVector_t>& d2psi_v_list) const;
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/dports/science/qmcpack/qmcpack-3.11.0/src/QMCWaveFunctions/Fermion/ |
H A D | DiracDeterminant.cpp | 212 RefVector<ValueVector_t> d2psi_v_list; in mw_ratioGrad() local 213 d2psi_v_list.reserve(wfc_list.size()); in mw_ratioGrad() 221 d2psi_v_list.push_back(det.d2psiV); in mw_ratioGrad() 224 Phi->mw_evaluateVGL(phi_list, p_list, iat, psi_v_list, dpsi_v_list, d2psi_v_list); in mw_ratioGrad()
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