Searched defs:EGOSet (Results 1 – 2 of 2) sorted by relevance
| /dports/science/qmcpack/qmcpack-3.11.0/src/QMCWaveFunctions/ElectronGas/ |
| H A D | ElectronGasComplexOrbitalBuilder.h | 28 struct EGOSet : public SPOSet struct
34 EGOSet(const std::vector<PosType>& k, const std::vector<RealType>& k2); argument
37 SPOSet* makeClone() const override { return new EGOSet(*this); } in makeClone() argument
39 void resetParameters(const opt_variables_type& optVariables) override {} in resetParameters()
40 void setOrbitalSetSize(int norbs) override {} in setOrbitalSetSize()
42 inline void evaluateValue(const ParticleSet& P, int iat, ValueVector_t& psi) override in evaluateValue()
60 …nst ParticleSet& P, int iat, ValueVector_t& psi, GradVector_t& dpsi, ValueVector_t& d2psi) override in evaluateVGL()
73 void evaluate_notranspose(const ParticleSet& P, in evaluate_notranspose()
97 …"Incomplete implementation EGOSet::evaluate(P,first,last,lodget,dlodet,grad_grad_logdet,grad_grad_… in evaluate_notranspose() argument
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| H A D | ElectronGasComplexOrbitalBuilder.cpp | 30 EGOSet::EGOSet(const std::vector<PosType>& k, const std::vector<RealType>& k2) : K(k), mK2(k2) in EGOSet() function in qmcplusplus::EGOSet
38 EGOSet::EGOSet(const std::vector<PosType>& k, const std::vector<RealType>& k2, const std::vector<in… in EGOSet() function in qmcplusplus::EGOSet
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