LOCALLY DENSE BASIS-SETS FOR CHEMICAL-SHIFT CALCULATIONS

[31] NEGBEN JW, 1966, J MOL SPECTROSC, V20, P72

[32] ONE-ELECTRON PROPERTIES OF NEAR-HARTREE-FOCK WAVEFUNCTIONS .2. HCHO CO [J]. JOURNAL OF CHEMICAL PHYSICS, 1969, 50 (05) : 2216 - +

[33] PROTON-ENHANCED NUCLEAR INDUCTION SPECTROSCOPY C-13 CHEMICAL SHIELDING ANISOTROPY IN SOME ORGANIC SOLIDS [J]. CHEMICAL PHYSICS LETTERS, 1972, 15 (03) : 373 - &

[34] THEORY OF MAGNETIC-SUSCEPTIBILITIES AND NMR CHEMICAL-SHIFTS IN TERMS OF LOCALIZED QUANTITIES .4. SOME SMALL MOLECULES WITH MULTIPLE BONDS (N2, HCN, CO, C2H2, CO2, N2O, O3, FNO) [J]. MOLECULAR PHYSICS, 1983, 48 (04) : 781 - 798

[35] MAGNETIC-PROPERTIES IN TERMS OF LOCALIZED QUANTITIES .7. APPLICATION TO NITROGEN NMR SHIFTS [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1987, 109 (20) : 5950 - 5955

[36] THEORY OF MAGNETIC-SUSCEPTIBILITIES AND NMR CHEMICAL-SHIFTS IN TERMS OF LOCALIZED QUANTITIES .2. APPLICATION TO SOME SIMPLE MOLECULES [J]. JOURNAL OF CHEMICAL PHYSICS, 1982, 76 (04) : 1919 - 1933

[37] THEORY OF MAGNETIC-SUSCEPTIBILITIES AND NMR CHEMICAL-SHIFTS IN TERMS OF LOCALIZED QUANTITIES .3. APPLICATION TO HYDROCARBONS AND OTHER ORGANIC-MOLECULES [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1983, 105 (05) : 1360 - 1370

[38] ADDITIONAL STUDIES CONCERNING EXISTENCE OF O3F2 [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1968, 90 (20) : 5408 - &

[39] COUPLED HARTREE-FOCK CALCULATIONS OF P-31 NMR SHIELDINGS IN PHOSPHORUS FLUORIDES AND PO4(3)- [J]. JOURNAL OF CHEMICAL PHYSICS, 1987, 86 (07) : 4066 - 4069

[40] ABINITIO COUPLED HARTREE-FOCK CALCULATION OF THE SI-29 NMR SHIELDING CONSTANTS IN SIH4, SI2H6, SI2H4 AND H2SIO [J]. CHEMICAL PHYSICS LETTERS, 1986, 128 (04) : 420 - 424

[31] NEGBEN JW, 1966, J MOL SPECTROSC, V20, P72

[32] ONE-ELECTRON PROPERTIES OF NEAR-HARTREE-FOCK WAVEFUNCTIONS .2. HCHO CO [J]. JOURNAL OF CHEMICAL PHYSICS, 1969, 50 (05) : 2216 - +

[33] PROTON-ENHANCED NUCLEAR INDUCTION SPECTROSCOPY C-13 CHEMICAL SHIELDING ANISOTROPY IN SOME ORGANIC SOLIDS [J]. CHEMICAL PHYSICS LETTERS, 1972, 15 (03) : 373 - &

[34] THEORY OF MAGNETIC-SUSCEPTIBILITIES AND NMR CHEMICAL-SHIFTS IN TERMS OF LOCALIZED QUANTITIES .4. SOME SMALL MOLECULES WITH MULTIPLE BONDS (N2, HCN, CO, C2H2, CO2, N2O, O3, FNO) [J]. MOLECULAR PHYSICS, 1983, 48 (04) : 781 - 798

[35] MAGNETIC-PROPERTIES IN TERMS OF LOCALIZED QUANTITIES .7. APPLICATION TO NITROGEN NMR SHIFTS [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1987, 109 (20) : 5950 - 5955

[36] THEORY OF MAGNETIC-SUSCEPTIBILITIES AND NMR CHEMICAL-SHIFTS IN TERMS OF LOCALIZED QUANTITIES .2. APPLICATION TO SOME SIMPLE MOLECULES [J]. JOURNAL OF CHEMICAL PHYSICS, 1982, 76 (04) : 1919 - 1933

[37] THEORY OF MAGNETIC-SUSCEPTIBILITIES AND NMR CHEMICAL-SHIFTS IN TERMS OF LOCALIZED QUANTITIES .3. APPLICATION TO HYDROCARBONS AND OTHER ORGANIC-MOLECULES [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1983, 105 (05) : 1360 - 1370

[38] ADDITIONAL STUDIES CONCERNING EXISTENCE OF O3F2 [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1968, 90 (20) : 5408 - &

[39] COUPLED HARTREE-FOCK CALCULATIONS OF P-31 NMR SHIELDINGS IN PHOSPHORUS FLUORIDES AND PO4(3)- [J]. JOURNAL OF CHEMICAL PHYSICS, 1987, 86 (07) : 4066 - 4069

[40] ABINITIO COUPLED HARTREE-FOCK CALCULATION OF THE SI-29 NMR SHIELDING CONSTANTS IN SIH4, SI2H6, SI2H4 AND H2SIO [J]. CHEMICAL PHYSICS LETTERS, 1986, 128 (04) : 420 - 424