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Atomic-orbital Based Ab-initio Computation at UStc
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Namespaces | Functions
write_elecstat_pot.cpp File Reference
#include "source_base/element_name.h"
#include "source_base/timer.h"
#include "source_io/module_parameter/parameter.h"
#include "source_estate/module_pot/H_Hartree_pw.h"
#include "source_estate/module_pot/efield.h"
#include "source_pw/module_pwdft/global.h"
#include "source_io/cube_io.h"
#include "source_io/output_log.h"
#include "write_elecstat_pot.h"
Include dependency graph for write_elecstat_pot.cpp:

Namespaces

namespace  ModuleIO
 This class has two functions: restart psi from the previous calculation, and write psi to the disk.
 

Functions

void ModuleIO::write_elecstat_pot (const int &bz, const int &nbz, const std::string &fn, const int &istep, ModulePW::PW_Basis *rho_basis, const Charge *const chr, const UnitCell *ucell_, const double *v_effective_fixed, const surchem &solvent)
 write electric static potential to file