Psi4
moinfo_scf.h
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28 
29 #ifndef _psi_src_lib_libmoinfo_moinfo_scf_h_
30 #define _psi_src_lib_libmoinfo_moinfo_scf_h_
31 
37 #include <string>
38 
40 #include "moinfo_base.h"
41 
42 namespace psi {
43 
44 class MOInfoSCF : public MOInfoBase {
45 public:
46  MOInfoSCF(Wavefunction& ref_wfn_, Options& options_, bool silent_ = false);
47  ~MOInfoSCF();
48 private:
49  void read_mo_spaces();
50  void print_mo();
51 };
52 
53 extern MOInfoSCF *moinfo_scf;
54 
55 }
56 
57 #endif // _psi_src_lib_libmoinfo_moinfo_scf_h_
Definition: moinfo_base.h:54
~MOInfoSCF()
Definition: moinfo_scf.cc:80
void print_mo()
Definition: moinfo_scf.cc:134
This class stores all the basic info regarding MOs.
MOInfoSCF(Wavefunction &ref_wfn_, Options &options_, bool silent_=false)
Definition: moinfo_scf.cc:47
void read_mo_spaces()
Definition: moinfo_scf.cc:84
Definition: liboptions.h:360
MOInfoSCF * moinfo_scf
Definition: mcscf.cc:59
Simple wavefunction base class.
Definition: wavefunction.h:84
Definition: moinfo_scf.h:44