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lines changed Original file line number Diff line number Diff line change @@ -31,7 +31,7 @@ elecstate::DensityMatrix<double, double> Force_LCAO<double>::cal_edm(const elecs
3131#ifdef __PEXSI
3232 if (PARAM.inp .ks_solver == " pexsi" )
3333 {
34- auto pes = dynamic_cast <const elecstate::ElecStateLCAO<double >*>(pelec);
34+ // auto pes = dynamic_cast<const elecstate::ElecStateLCAO<double>*>(pelec);
3535 for (int ik = 0 ; ik < nspin; ik++)
3636 {
3737 edm.set_DMK_pointer (ik, dm.pexsi_EDM [ik]);
@@ -47,7 +47,8 @@ elecstate::DensityMatrix<double, double> Force_LCAO<double>::cal_edm(const elecs
4747}
4848
4949template <>
50- elecstate::DensityMatrix<std::complex <double >, double > Force_LCAO<std::complex <double >>::cal_edm(const elecstate::ElecState* pelec,
50+ elecstate::DensityMatrix<std::complex <double >, double > Force_LCAO<std::complex <double >>::cal_edm(
51+ const elecstate::ElecState* pelec,
5152 const psi::Psi<std::complex <double >>& psi,
5253 const elecstate::DensityMatrix<std::complex <double >, double >& dm,
5354 const K_Vectors& kv,
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