VARIANT OF CNDO-METHOD INCLUDING D-FUNCTIONS

[1] MOLECULAR-STRUCTURE OF METHYLENE BROMIDE - COMPARISON OF STRUCTURES OF HALOGENOMETHANES [J]. JOURNAL OF MOLECULAR STRUCTURE, 1975, 25 (01) : 216 - 218

[2] Cross P. C, 1955, MOL VIBRATIONS

[3] CNDO/2 AND INDO ALL-VALENCE-ELECTRON CALCULATIONS ON GEOMETRY AND PROPERTIES OF SOME INTERHALOGENS [J]. JOURNAL OF THE CHEMICAL SOCIETY A -INORGANIC PHYSICAL THEORETICAL, 1971, (08): : 958 - &

[4] Fletcher R, 1972, FORTRAN SUBROUTINES

[5] INDO INVESTIGATION OF HALOGEN NQR FREQUENCIES AND N-14 NUCLEAR-QUADRUPOLE COUPLING-CONSTANTS OF HALOTHIOPHENES AND HALOPYRIDINES [J]. THEORETICA CHIMICA ACTA, 1974, 34 (02): : 137 - 144

[6] 2ND-ROW MOLECULAR-ORBITAL CALCULATIONS .2. SEMIEMPIRICAL CALCULATIONS OF DIPOLE-MOMENTS [J]. JOURNAL OF MOLECULAR STRUCTURE, 1975, 28 (02) : 255 - 267

[7] APPROXIMATE SELF-CONSISTENT FIELD MOLECULAR-ORBITAL CALCULATION ON TRITHIADIBOROLANE, DICHLOROTRITHIADIBOROLANE, DIMETHYLTRITHIADIBOROLANE, TRIOXADIBOROLANE, DICHLOROTRIOXADIBOROLANE, AND DIMETHYLTRIOXADIBOROLANE [J]. ACTA CHEMICA SCANDINAVICA, 1973, 27 (08): : 3079 - 3084

[8] CNDO-2 (COMPLETE NEGLECT OF DIFFERENTIAL OVERLAP) - METHOD FOR THIRD-ROW MOLECULES [J]. THEORETICA CHIMICA ACTA, 1973, 31 (03): : 215 - 220

[9] MODIFICATION AND EXTENSION OF CNDO METHOD .1. PARAMETERS FOR ATOMS HYDROGEN TO CHLORINE, POTASSIUM, CALCIUM, AND GALLIUM TO BROMINE [J]. ACTA CHEMICA SCANDINAVICA, 1972, 26 (09): : 3723 - 3743

[10] CNDO-2 STUDY OF SOME POLYVALENT IODINE COMPOUNDS .1. NEGATIVE-IONS [J]. AUSTRALIAN JOURNAL OF CHEMISTRY, 1974, 27 (07) : 1381 - 1389

[1] MOLECULAR-STRUCTURE OF METHYLENE BROMIDE - COMPARISON OF STRUCTURES OF HALOGENOMETHANES [J]. JOURNAL OF MOLECULAR STRUCTURE, 1975, 25 (01) : 216 - 218

[2] Cross P. C, 1955, MOL VIBRATIONS

[3] CNDO/2 AND INDO ALL-VALENCE-ELECTRON CALCULATIONS ON GEOMETRY AND PROPERTIES OF SOME INTERHALOGENS [J]. JOURNAL OF THE CHEMICAL SOCIETY A -INORGANIC PHYSICAL THEORETICAL, 1971, (08): : 958 - &

[4] Fletcher R, 1972, FORTRAN SUBROUTINES

[5] INDO INVESTIGATION OF HALOGEN NQR FREQUENCIES AND N-14 NUCLEAR-QUADRUPOLE COUPLING-CONSTANTS OF HALOTHIOPHENES AND HALOPYRIDINES [J]. THEORETICA CHIMICA ACTA, 1974, 34 (02): : 137 - 144

[6] 2ND-ROW MOLECULAR-ORBITAL CALCULATIONS .2. SEMIEMPIRICAL CALCULATIONS OF DIPOLE-MOMENTS [J]. JOURNAL OF MOLECULAR STRUCTURE, 1975, 28 (02) : 255 - 267

[7] APPROXIMATE SELF-CONSISTENT FIELD MOLECULAR-ORBITAL CALCULATION ON TRITHIADIBOROLANE, DICHLOROTRITHIADIBOROLANE, DIMETHYLTRITHIADIBOROLANE, TRIOXADIBOROLANE, DICHLOROTRIOXADIBOROLANE, AND DIMETHYLTRIOXADIBOROLANE [J]. ACTA CHEMICA SCANDINAVICA, 1973, 27 (08): : 3079 - 3084

[8] CNDO-2 (COMPLETE NEGLECT OF DIFFERENTIAL OVERLAP) - METHOD FOR THIRD-ROW MOLECULES [J]. THEORETICA CHIMICA ACTA, 1973, 31 (03): : 215 - 220

[9] MODIFICATION AND EXTENSION OF CNDO METHOD .1. PARAMETERS FOR ATOMS HYDROGEN TO CHLORINE, POTASSIUM, CALCIUM, AND GALLIUM TO BROMINE [J]. ACTA CHEMICA SCANDINAVICA, 1972, 26 (09): : 3723 - 3743

[10] CNDO-2 STUDY OF SOME POLYVALENT IODINE COMPOUNDS .1. NEGATIVE-IONS [J]. AUSTRALIAN JOURNAL OF CHEMISTRY, 1974, 27 (07) : 1381 - 1389