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ABACUS develop
Atomic-orbital Based Ab-initio Computation at UStc
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#include "dftu.h"#include "source_base/timer.h"#include "source_io/module_parameter/parameter.h"#include "source_pw/module_pwdft/global.h"Namespaces | |
| namespace | ModuleDFTU |
Functions | |
| std::vector< double > | ModuleDFTU::CalculateEigenvalues (std::vector< std::vector< double > > &A, int n) |
| void | ModuleDFTU::JacobiRotate (std::vector< std::vector< double > > &A, int p, int q, int n) |