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camelto2 committed Mar 9, 2023
1 parent ae40feb commit bf0ba13
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Showing 3 changed files with 1 addition and 4 deletions.
1 change: 0 additions & 1 deletion src/QMCHamiltonians/NonLocalECPotential.h
Original file line number Diff line number Diff line change
Expand Up @@ -242,7 +242,6 @@ class NonLocalECPotential : public OperatorBase, public ForceBase
ParticleSet::ParticlePos& hf_terms,
ParticleSet::ParticlePos& pulay_terms,
bool keepGrid = false);

/** compute the T move transition probability for a given electron
* member variable nonLocalOps.Txy is updated
* @param P particle set
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1 change: 0 additions & 1 deletion src/QMCHamiltonians/SOECPComponent.cpp
Original file line number Diff line number Diff line change
Expand Up @@ -398,7 +398,6 @@ void SOECPComponent::buildTotalQuadrature(const RealType r, const PosType& dr, c
//also set the radial function
for (int ip = 0; ip < nchannel_; ip++)
vrad_[ip] = sopp_m_[ip]->splint(r);

}

void SOECPComponent::rotateQuadratureGrid(const TensorType& rmat)
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3 changes: 1 addition & 2 deletions src/QMCHamiltonians/tests/test_SOECPotential.cpp
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Expand Up @@ -39,8 +39,7 @@ class TestSOECPotential
{
return so_ecp.PPset_[0]->rrotsgrid_m_ != so_ecp.PPset_[0]->sgridxyz_m_;
}
static void addVPs(const RefVectorWithLeader<OperatorBase>& o_list,
const RefVectorWithLeader<ParticleSet>& p_list)
static void addVPs(const RefVectorWithLeader<OperatorBase>& o_list, const RefVectorWithLeader<ParticleSet>& p_list)
{
for (size_t iw = 0; iw < o_list.size(); iw++)
{
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