ABACUS develop
Atomic-orbital Based Ab-initio Computation at UStc
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write_pao.h
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2namespace ModuleIO
3{
9 void print_PAOs(const UnitCell& ucell);
10}
Definition unitcell.h:16
This class has two functions: restart psi from the previous calculation, and write psi to the disk.
Definition cal_dos.h:9
void print_PAOs(const UnitCell &ucell)
print chi (PAO) in pseudopotential file
Definition write_pao.cpp:8