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CheMPS2
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This is the complete list of members for CheMPS2::Hamiltonian, including all inherited members.
| addToVmat(const int index1, const int index2, const int index3, const int index4, const double val) | CheMPS2::Hamiltonian | |
| debugcheck() const | CheMPS2::Hamiltonian | |
| getEconst() const | CheMPS2::Hamiltonian | |
| getL() const | CheMPS2::Hamiltonian | |
| getNGroup() const | CheMPS2::Hamiltonian | |
| getOrbitalIrrep(const int nOrb) const | CheMPS2::Hamiltonian | |
| getTmat(const int index1, const int index2) const | CheMPS2::Hamiltonian | |
| getTmat() | CheMPS2::Hamiltonian | |
| getVmat(const int index1, const int index2, const int index3, const int index4) const | CheMPS2::Hamiltonian | |
| getVmat() | CheMPS2::Hamiltonian | |
| Hamiltonian(const int Norbitals, const int nGroup, const int *OrbIrreps) | CheMPS2::Hamiltonian | |
| Hamiltonian(const string filename, const int psi4groupnumber) | CheMPS2::Hamiltonian | |
| Hamiltonian(const bool fileh5, const string main_file=HAMILTONIAN_ParentStorageName, const string file_tmat=HAMILTONIAN_TmatStorageName, const string file_vmat=HAMILTONIAN_VmatStorageName) | CheMPS2::Hamiltonian | |
| read(const string file_parent=HAMILTONIAN_ParentStorageName, const string file_tmat=HAMILTONIAN_TmatStorageName, const string file_vmat=HAMILTONIAN_VmatStorageName) | CheMPS2::Hamiltonian | |
| readfock(const string fockfile, double *fockmx, const bool printinfo) const | CheMPS2::Hamiltonian | |
| save(const string file_parent=HAMILTONIAN_ParentStorageName, const string file_tmat=HAMILTONIAN_TmatStorageName, const string file_vmat=HAMILTONIAN_VmatStorageName) const | CheMPS2::Hamiltonian | |
| setEconst(const double val) | CheMPS2::Hamiltonian | |
| setTmat(const int index1, const int index2, const double val) | CheMPS2::Hamiltonian | |
| setVmat(const int index1, const int index2, const int index3, const int index4, const double val) | CheMPS2::Hamiltonian | |
| writeFCIDUMP(const string fcidumpfile, const int Nelec, const int TwoS, const int TargetIrrep) const | CheMPS2::Hamiltonian | |
| ~Hamiltonian() | CheMPS2::Hamiltonian | virtual |