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Atomic-orbital Based Ab-initio Computation at UStc
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cif_io.h File Reference
#include "source_cell/unitcell.h"
#include <string>
#include <vector>
#include <map>
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Classes

class  ModuleIO::CifParser
 

Namespaces

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