/usr/include/libmoinfo/moinfo_scf.h is in libpsi3-dev 3.4.0-6build2.
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1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 | #ifndef _psi_src_lib_libmoinfo_moinfo_scf_h_
#define _psi_src_lib_libmoinfo_moinfo_scf_h_
/*! \file
\ingroup LIBMOINFO
\brief This class stores all the basic info regarding MOs
*/
#include <string>
#include "moinfo_base.h"
namespace psi {
class MOInfoSCF : public MOInfoBase {
public:
MOInfoSCF();
~MOInfoSCF();
private:
void read_mo_spaces();
void print_mo();
};
extern MOInfoSCF *moinfo_scf;
}
#endif // _psi_src_lib_libmoinfo_moinfo_scf_h_
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