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Author:Allen, W.D.

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9 matching references were found.

Wladkowski, B.D.; East, A.L.L.; Mihalick, J.E.; Allen, W.D.; Brauman, J.I., The Proton-Transfer Surface of Ch3OHF-, J. Chem. Phys., 1994, 100, 3, 2058, https://doi.org/10.1063/1.466506 . [all data]

Allen, W.D.; Bertie, J.E.; Falk, M.V.; Hess, B.A., Jr.; Mast, G.B.; Othen, D.A.; Schaad, L.J.; Schaefer, H.F., III, The experimental vibrational spectra, vibrational assignment, and normal coordinate analysis of thiirane-h4 and -d4 and cis- and trans-1,2-dideuteriothiirane: Ab initio theoretical IR spectra of thiirane, thiirene, and isotopically substituted derivatives, J. Chem. Phys., 1986, 84, 8, 4211, https://doi.org/10.1063/1.450043 . [all data]

Gerbig, D.; Reisenauer, H.P.; Wu, C.-H.; Ley, D.; Allen, W.D.; Schreiner, P.R., Phenylhydroxycarbene, J. Am. Chem. Soc., 2010, 132, 21, 7273, https://doi.org/10.1021/ja9107885 . [all data]

Schreiner, P.R.; Reisenauer, H.P.; Ley, D.; Gerbig, D.; Wu, C.-H.; Allen, W.D., Methylhydroxycarbene: Tunneling Control of a Chemical Reaction, Science, 2011, 332, 6035, 1300, https://doi.org/10.1126/science.1203761 . [all data]

Schreiner, P.R.; Reisenauer, H.P.; Matyus, E.; Csaszar, A.G.; Siddiqi, A.; Simmonett, A.C.; Allen, W.D., Infrared signatures of the NCCO radical, Phys. Chem. Chem. Phys., 2009, 11, 44, 10385, https://doi.org/10.1039/b912803d . [all data]

Schreiner, P.R.; Reisenauer, H.P.; Pickard IV, F.C.; Simmonett, A.C.; Allen, W.D.; Matyus, E.; Csaszar, A.G., Capture of hydroxymethylene and its fast disappearance through tunnelling, Nature, 2008, 453, 7197, 906, https://doi.org/10.1038/nature07010 . [all data]

Schreiner, P.R.; Reisenauer, H.P.; Sattelmeyer, K.W.; Allen, W.D., H-C-SiH, J. Am. Chem. Soc., 2005, 127, 35, 12156, https://doi.org/10.1021/ja052043r . [all data]

Allen, W.D.; Csaszar, A.G.; Horner, D.A., The Puckering Inversion Barrier and Vibrational Spectrum of Cyclopentene A Scaled Quantum Mechanical Force Field Algorithm, J. Am. Chem. Soc., 1992, 114, 6834. [all data]

Allen, W.D.; Yamaguchi, Y.; Csaszar, A.G.; Clabo, D.A.; Remington, R.B.; Schaefer, H.F., A systematic study of molecular vibrational anharmonicity and vibration- rotation interaction by self-consistent-field higher-derivative methods. Linear polyatomic molecules, Chem. Phys., 1990, 145, 427-66. [all data]