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John H Hall - Publications

Affiliations: 
Clark Atlanta University 
Area:
Theoretical chemistry
Website:
https://www.thehistorymakers.org/biography/john-h-hall-jr-41
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13 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
1991 Morris VR, Bhatia SC, Hall JH. Ab-initio self-consistent-field study of the vibrational spectra for NO3 geometric isomers. 2. Isotopic shifts of sym-NO3 The Journal of Physical Chemistry. 95: 9203-9208. DOI: 10.1021/J100176A032  0.33
1985 Bhatia SC, Hall JH. Ab initio self‐consistent‐field studies of ClNOx (x=1–3) The Journal of Chemical Physics. 82: 1991-1996. DOI: 10.1063/1.448382  0.336
1977 Dixon DA, Kleier DA, Halgren TA, Hall JH, Lipscomb WN. Localized orbitals for polyatomic molecules. 5. The closo boron hydrides BnHn2- and carboranes C2Bn-2Hn Journal of the American Chemical Society. 99: 6226-6237. DOI: 10.1021/Ja00461A009  0.529
1975 Hall JH, Dixon DA, Kleier DA, Halgren TA, Brown LD, Lipscomb WN. Localized molecular orbitals for polyatomic molecules. II. Structural relations and charge distributions for open boron hydrides and ions Journal of the American Chemical Society. 97: 4202-4213. DOI: 10.1021/Ja00848A010  0.517
1974 Kleier DA, Hall JH, Halgren TA, Lipscomb WN. Localized molecular orbital description of nitrogen lone pairs. Proceedings of the National Academy of Sciences of the United States of America. 71: 2265-7. PMID 16592157 DOI: 10.1073/Pnas.71.6.2265  0.488
1974 Marynick DS, Hall JH, Lipscomb WN. Energy of formation of B2H6 from 2BH3 near the Hartree‐Fock limit The Journal of Chemical Physics. 61: 5460-5461. DOI: 10.1063/1.1681901  0.38
1974 Kleier DA, Halgren TA, Hall JH, Lipscomb WN. Localized molecular orbitals for polyatomic molecules. I. A comparison of the Edmiston‐Ruedenberg and Boys localization methods The Journal of Chemical Physics. 61: 3905-3919. DOI: 10.1063/1.1681683  0.462
1974 Hall JH, Marynick DS, Lipscomb WN. Self-consistent field wave functions of boron hydrides and ions. Octaborane(12), nonaborane(15), hexahydrohexaborate(2-), decahydrodecaborate(2-), and tetradecahydrodecaborate(2-) Journal of the American Chemical Society. 96: 770-779. DOI: 10.1021/Ja00810A022  0.435
1974 Hall JH, Halgren TA, Kleier DA, Lipscomb WN. Localized orbitals in boron fluorides. Highly polarized boron-fluorine double and triple bonds Inorganic Chemistry. 13: 2520-2521. DOI: 10.1021/Ic50140A044  0.46
1974 Hall JH, Lipscomb WN. Ab initio self-consistent-field study of boron halides. Tetraboron tetrafluoride and tetraboron tetrachloride Inorganic Chemistry. 13: 710-714. DOI: 10.1021/Ic50133A039  0.477
1973 Hall JH, Epstein IR, Lipscomb WN. Optimized self-consistent-field and localized molecular orbital studies of tetraborane (4) Inorganic Chemistry. 12: 915-920. DOI: 10.1021/Ic50122A043  0.568
1973 Hall JH, Epstein IR, Lipscomb WN. Optimalisierte Scf- Und Lokalisierte Molekuelorbital-Untersuchungen Von Tetraboran(4) Cheminform. 4. DOI: 10.1002/Chin.197323003  0.5
1972 Hall JH, Marynick DS, Lipscomb WN. Ab initio self-consistent field calculation of the heats of formation of B2H6 and B2H7 Inorganic Chemistry. 11: 3126-3128. DOI: 10.1021/Ic50118A056  0.468
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