/dports/science/qmcpack/qmcpack-3.11.0/src/spline2/ |
H A D | MultiBspline1D.hpp | 105 evaluate_vgl_impl(r, psi.data(), grad.data(), lap.data()); in evaluate_vgl() 117 void evaluate_vgl_impl(T r, T* restrict vals, T* restrict grads, T* restrict lapl) const; 144 inline void MultiBspline1D<T>::evaluate_vgl_impl(T x, T* restrict vals, T* restrict grads, T* restr… in evaluate_vgl_impl() function in qmcplusplus::MultiBspline1D
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H A D | MultiBsplineEval.hpp | 58 …evaluate_vgl_impl(spline, r[0], r[1], r[2], psi.data(), grad.data(), lap.data(), psi.size(), 0, ps… in evaluate3d_vgl() 64 …evaluate_vgl_impl(spline, r[0], r[1], r[2], psi.data() + first, grad.data() + first, lap.data() + … in evaluate3d_vgl()
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H A D | MultiBsplineVGLH.hpp | 29 inline void evaluate_vgl_impl(const typename qmcplusplus::bspline_traits<T, 3>::SplineType* restric… in evaluate_vgl_impl() function
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H A D | MultiBsplineVGLH_OMPoffload.hpp | 33 inline void evaluate_vgl_impl(const typename qmcplusplus::bspline_traits<T, 3>::SplineType* restric… in evaluate_vgl_impl() function
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/dports/science/qmcpack/qmcpack-3.11.0/src/QMCWaveFunctions/LCAO/ |
H A D | LCAOrbitalSet.h | 231 …void evaluate_vgl_impl(const vgl_type& temp, ValueVector_t& psi, GradVector_t& dpsi, ValueVector_t… 233 void evaluate_vgl_impl(const vgl_type& temp,
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H A D | LCAOrbitalSet.cpp | 112 inline void LCAOrbitalSet::evaluate_vgl_impl(const vgl_type& temp, in evaluate_vgl_impl() function in qmcplusplus::LCAOrbitalSet 320 evaluate_vgl_impl(Temp, psi, dpsi, d2psi); in evaluateVGL() 326 evaluate_vgl_impl(Tempv, psi, dpsi, d2psi); in evaluateVGL() 389 inline void LCAOrbitalSet::evaluate_vgl_impl(const vgl_type& temp, in evaluate_vgl_impl() function in qmcplusplus::LCAOrbitalSet 521 evaluate_vgl_impl(Temp, i, logdet, dlogdet, d2logdet); in evaluate_notranspose() 532 evaluate_vgl_impl(Tempv, i, logdet, dlogdet, d2logdet); in evaluate_notranspose()
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/dports/science/qmcpack/qmcpack-3.11.0/src/QMCWaveFunctions/Fermion/ |
H A D | MultiSlaterDeterminantFast.h | 100 PsiValueType evaluate_vgl_impl(const ParticleSet& P,
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H A D | MultiSlaterDeterminantFast.cpp | 164 WaveFunctionComponent::PsiValueType MultiSlaterDeterminantFast::evaluate_vgl_impl( in evaluate_vgl_impl() function in qmcplusplus::MultiSlaterDeterminantFast 202 psiCurrent = evaluate_vgl_impl(P, myG, myL); in evaluate() 418 psiCurrent = evaluate_vgl_impl(P, myG, myL); in updateBuffer()
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