A MODIFIED COUPLED PAIR FUNCTIONAL-APPROACH

[1] THE COUPLED PAIR FUNCTIONAL (CPF) - A SIZE CONSISTENT MODIFICATION OF THE CI(SD) BASED ON AN ENERGY FUNCTIONAL [J]. JOURNAL OF CHEMICAL PHYSICS, 1985, 82 (02) : 890 - 898

[2] MANY-BODY PERTURBATION CALCULATIONS AND COUPLED ELECTRON PAIR MODELS [J]. COMPUTER PHYSICS COMMUNICATIONS, 1979, 17 (1-2) : 31 - 45

[3] THE IMPACT OF HIGHER POLARIZATION BASIS FUNCTIONS ON MOLECULAR AB-INITIO RESULTS .2. THE GROUND-STATES OF CO, N-2 NO, O-2, AND F2 [J]. CHEMICAL PHYSICS, 1985, 98 (03) : 381 - 386

[4] BAUSCHLICHER CW, UNPUB QUANTUM CHEM C

[5] CHONG DP, UNPUB J CHEM PHYS

[6] CIZEK J, 1966, J CHEM PHYS, V45, P4256

[7] ITERATIVE CALCULATION OF A FEW OF LOWEST EIGENVALUES AND CORRESPONDING EIGENVECTORS OF LARGE REAL-SYMMETRIC MATRICES [J]. JOURNAL OF COMPUTATIONAL PHYSICS, 1975, 17 (01) : 87 - 94

[8] Dykstra C. E., 1983, ADV THEORIES COMPUTA

[9] GREY JA, 1985, J CHEM PHYS, V82, P4717

[10] GAUSSIAN BASIS SETS FOR MOLECULAR CALCULATIONS - REPRESENTATION OF 3D ORBITALS IN TRANSITION-METAL ATOMS [J]. JOURNAL OF CHEMICAL PHYSICS, 1977, 66 (10) : 4377 - 4384

[1] THE COUPLED PAIR FUNCTIONAL (CPF) - A SIZE CONSISTENT MODIFICATION OF THE CI(SD) BASED ON AN ENERGY FUNCTIONAL [J]. JOURNAL OF CHEMICAL PHYSICS, 1985, 82 (02) : 890 - 898

[2] MANY-BODY PERTURBATION CALCULATIONS AND COUPLED ELECTRON PAIR MODELS [J]. COMPUTER PHYSICS COMMUNICATIONS, 1979, 17 (1-2) : 31 - 45

[3] THE IMPACT OF HIGHER POLARIZATION BASIS FUNCTIONS ON MOLECULAR AB-INITIO RESULTS .2. THE GROUND-STATES OF CO, N-2 NO, O-2, AND F2 [J]. CHEMICAL PHYSICS, 1985, 98 (03) : 381 - 386

[4] BAUSCHLICHER CW, UNPUB QUANTUM CHEM C

[5] CHONG DP, UNPUB J CHEM PHYS

[6] CIZEK J, 1966, J CHEM PHYS, V45, P4256

[7] ITERATIVE CALCULATION OF A FEW OF LOWEST EIGENVALUES AND CORRESPONDING EIGENVECTORS OF LARGE REAL-SYMMETRIC MATRICES [J]. JOURNAL OF COMPUTATIONAL PHYSICS, 1975, 17 (01) : 87 - 94

[8] Dykstra C. E., 1983, ADV THEORIES COMPUTA

[9] GREY JA, 1985, J CHEM PHYS, V82, P4717

[10] GAUSSIAN BASIS SETS FOR MOLECULAR CALCULATIONS - REPRESENTATION OF 3D ORBITALS IN TRANSITION-METAL ATOMS [J]. JOURNAL OF CHEMICAL PHYSICS, 1977, 66 (10) : 4377 - 4384