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| William
C. Bailey |
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| Ph.D., State University of New York at Albany, 1971 | ||
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| I'm
the one on the
left. |
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| Professor
of Physics |
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| Chemistry-Physics
Department |
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| Kean
University |
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| Union,
NJ 07083 |
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| e-mail: wcbailey@mac.com |
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| Research | ||
| Calculation of Nuclear Quadrupole Coupling Constants in Gaseous State Molecules |
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| Recent
Publications |
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| "Calculation of bromine nuclear quadrupole coupling constants in gaseous state molecules", with F. M. Gonzalez, J. Mol. Struct. 651-653, 689 (2002). Full text PDF. | ||
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| "Calculation of 14N and 33S quadrupole coupling constants on optimized molecular structures of thiazole", J. Mol. Spectrosc. 209, 57 (2001). Full text PDF. | ||
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| "DFT and HF-DFT calculation of 14N and 35Cl quadrupole coupling constants on optimized molecular structures of pyrimidine, 2-X- and 5-X-pyrimidine , with X = F, Cl, Br, and CN", Chem. Phys. 269, 75 (2001). Full text PDF. | ||
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| "DFT and HF-DFT calculation of 14N and 35Cl quadrupole coupling constants on optimized molecular structures of pyridine and the monochloropyridines", J. Mol. Struct. (Theochem) 541, 195 (2001). Full text PDF. | ||
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| "DFT and HF-DFT calculation of 17O, 33S, and 73Ge quadrupole coupling constants", with F. M. Gonzalez and J. Castiglione, Chem. Phys. 260, 327 (2000). Full text PDF. | ||
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| "DFT and HF-DFT calculation of 14N quadrupole coupling constants in molecules", Chem. Phys. 252, 57 (2000). Full text PDF. | ||
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| "B3LYP calculation of 17O quadrupole coupling constants in molecules", Chem. Phys. Lett. 292, 71 (1998). Full text PDF. | ||
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| "B3LYP calculation of deuterium quadrupole coupling constants in molecules", J. Mol. Spectrosc. 190, 318 (1998). Full text PDF. | ||
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| "Prediction
of 11B
quadrupole coupling constants in molecules", J.
Mol. Spectrosc. 185,
403 (1997). Full text PDF. |
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| Poster Presentation | ||
| "Calculation of 14N Quadrupole Coupling Constants on Optimized Molecular Structures of N-Methylpyrrole" Molecular Quantum Mechanics, An International Conference, University of Washington, July 2001. Poster PDF. | ||
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