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Atomic-orbital Based Ab-initio Computation at UStc
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check_atomic_stru.cpp File Reference
#include "check_atomic_stru.h"
#include "source_base/element_covalent_radius.h"
#include "source_base/timer.h"
Include dependency graph for check_atomic_stru.cpp:

Namespaces

namespace  unitcell
 

Functions

void unitcell::check_atomic_stru (UnitCell &ucell, const double &factor)