AN ABINITIO CALCULATION OF N-14 QUADRUPOLE COUPLING-CONSTANTS

[1] ABINITIO SCF-MO CALCULATIONS ON CH3BR MOLECULE [J]. THEORETICA CHIMICA ACTA, 1977, 45 (02): : 121 - 126

[2] THE CHEMICAL SIGNIFICANCE OF QUADRUPOLE SPECTRA [J]. JOURNAL OF PHYSICAL CHEMISTRY, 1953, 57 (05) : 490 - 496

[3] QUANTUM ORGANIC-CHEMISTRY [J]. SCIENCE, 1975, 187 (4181) : 1037 - 1044

[4] MINDO-3 STUDY OF N-14 NUCLEAR-QUADRUPOLE COUPLING-CONSTANTS [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (19) : 5590 - 5592

[5] GAUSSIAN BASIS FUNCTIONS FOR USE IN MOLECULAR CALCULATIONS .3. CONTRACTION OF (10S6P) ATOMIC BASIS SETS FOR FIRST-ROW ATOMS [J]. JOURNAL OF CHEMICAL PHYSICS, 1971, 55 (02) : 716 - +

[6] ELECTRIC DIPOLE-MOMENT OF DIATOMIC-MOLECULES BY CONFIGURATION INTERACTION .3. OPEN-SHELL MOLECULES CO A3II AND CS A1II [J]. JOURNAL OF CHEMICAL PHYSICS, 1972, 56 (02) : 739 - &

[7] HINCHLIFFE A, 1974, QUANTUM CHEM SPECIAL, V3, pCH3

[8] INTERPRETATION OF NUCLEAR QUADRUPOLE COUPLING IN NITROGEN CONTAINING MOLECULES WITH AB INITIO MOLECULAR-ORBITAL WAVEFUNCTIONS [J]. JOURNAL OF CHEMICAL PHYSICS, 1968, 49 (12) : 5354 - &

[9] ORVILLETHOMAS WJ, 1956, Q REV LONDON, V10, P162

[10] RICHARDS WG, 1971, BIBLIOGRAPHY AB INIT

[1] ABINITIO SCF-MO CALCULATIONS ON CH3BR MOLECULE [J]. THEORETICA CHIMICA ACTA, 1977, 45 (02): : 121 - 126

[2] THE CHEMICAL SIGNIFICANCE OF QUADRUPOLE SPECTRA [J]. JOURNAL OF PHYSICAL CHEMISTRY, 1953, 57 (05) : 490 - 496

[3] QUANTUM ORGANIC-CHEMISTRY [J]. SCIENCE, 1975, 187 (4181) : 1037 - 1044

[4] MINDO-3 STUDY OF N-14 NUCLEAR-QUADRUPOLE COUPLING-CONSTANTS [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (19) : 5590 - 5592

[5] GAUSSIAN BASIS FUNCTIONS FOR USE IN MOLECULAR CALCULATIONS .3. CONTRACTION OF (10S6P) ATOMIC BASIS SETS FOR FIRST-ROW ATOMS [J]. JOURNAL OF CHEMICAL PHYSICS, 1971, 55 (02) : 716 - +

[6] ELECTRIC DIPOLE-MOMENT OF DIATOMIC-MOLECULES BY CONFIGURATION INTERACTION .3. OPEN-SHELL MOLECULES CO A3II AND CS A1II [J]. JOURNAL OF CHEMICAL PHYSICS, 1972, 56 (02) : 739 - &

[7] HINCHLIFFE A, 1974, QUANTUM CHEM SPECIAL, V3, pCH3

[8] INTERPRETATION OF NUCLEAR QUADRUPOLE COUPLING IN NITROGEN CONTAINING MOLECULES WITH AB INITIO MOLECULAR-ORBITAL WAVEFUNCTIONS [J]. JOURNAL OF CHEMICAL PHYSICS, 1968, 49 (12) : 5354 - &

[9] ORVILLETHOMAS WJ, 1956, Q REV LONDON, V10, P162

[10] RICHARDS WG, 1971, BIBLIOGRAPHY AB INIT