A QUADRATICALLY CONVERGENT MCSCF SCHEME USING FOCK OPERATORS

[11] ROOTHAAN CCJ, 1979, INT J QUANTUM CHEM, V13, P93

[12] MCSCF OPTIMIZATION THROUGH COMBINED USE OF NATURAL ORBITALS AND THE BRILLOUIN-LEVY-BERTHIER THEOREM [J]. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1979, 16 (05) : 1069 - 1101

[13] GAUSSIAN BASIS SET FOR MOLECULAR WAVEFUNCTIONS CONTAINING THIRD-ROW ATOMS [J]. JOURNAL OF CHEMICAL PHYSICS, 1970, 52 (03) : 1033 - &

[14] WAHL AC, 1976, MODERN THEORETICAL C, V3, pCH3

[15] A QUADRATICALLY CONVERGENT MULTICONFIGURATION-SELF-CONSISTENT FIELD METHOD WITH SIMULTANEOUS-OPTIMIZATION OF ORBITALS AND CL COEFFICIENTS [J]. JOURNAL OF CHEMICAL PHYSICS, 1980, 73 (05) : 2342 - 2356

[16] ORBITAL OPTIMIZATION IN ELECTRONIC WAVE-FUNCTIONS - EQUATIONS FOR QUADRATIC AND CUBIC CONVERGENCE OF GENERAL MULTICONFIGURATION WAVE-FUNCTIONS [J]. PHYSICAL REVIEW A, 1976, 13 (05): : 1682 - 1691

[17] NUMERICAL STUDY OF THE CONVERGENCY OF 2ND AND APPROXIMATE 2ND-ORDER MULTICONFIGURATION HARTREE-FOCK PROCEDURES [J]. MOLECULAR PHYSICS, 1980, 39 (03) : 587 - 596

[18] CONVERGENCY STUDIES OF SECOND AND APPROXIMATE 2ND ORDER MULTICONFIGURATIONAL HARTREE-FOCK PROCEDURES [J]. JOURNAL OF CHEMICAL PHYSICS, 1979, 71 (02) : 755 - 760

[11] ROOTHAAN CCJ, 1979, INT J QUANTUM CHEM, V13, P93

[12] MCSCF OPTIMIZATION THROUGH COMBINED USE OF NATURAL ORBITALS AND THE BRILLOUIN-LEVY-BERTHIER THEOREM [J]. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1979, 16 (05) : 1069 - 1101

[13] GAUSSIAN BASIS SET FOR MOLECULAR WAVEFUNCTIONS CONTAINING THIRD-ROW ATOMS [J]. JOURNAL OF CHEMICAL PHYSICS, 1970, 52 (03) : 1033 - &

[14] WAHL AC, 1976, MODERN THEORETICAL C, V3, pCH3

[15] A QUADRATICALLY CONVERGENT MULTICONFIGURATION-SELF-CONSISTENT FIELD METHOD WITH SIMULTANEOUS-OPTIMIZATION OF ORBITALS AND CL COEFFICIENTS [J]. JOURNAL OF CHEMICAL PHYSICS, 1980, 73 (05) : 2342 - 2356

[16] ORBITAL OPTIMIZATION IN ELECTRONIC WAVE-FUNCTIONS - EQUATIONS FOR QUADRATIC AND CUBIC CONVERGENCE OF GENERAL MULTICONFIGURATION WAVE-FUNCTIONS [J]. PHYSICAL REVIEW A, 1976, 13 (05): : 1682 - 1691

[17] NUMERICAL STUDY OF THE CONVERGENCY OF 2ND AND APPROXIMATE 2ND-ORDER MULTICONFIGURATION HARTREE-FOCK PROCEDURES [J]. MOLECULAR PHYSICS, 1980, 39 (03) : 587 - 596

[18] CONVERGENCY STUDIES OF SECOND AND APPROXIMATE 2ND ORDER MULTICONFIGURATIONAL HARTREE-FOCK PROCEDURES [J]. JOURNAL OF CHEMICAL PHYSICS, 1979, 71 (02) : 755 - 760