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Albert F. Wagner

Affiliations: 
Argonne National Laboratory, Lemont, IL, United States 
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"Albert F. Wagner"
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DOI: 10.1021/acs.jpca.5b01914
Wagner, Albert Fordyce I. The Classification of Exact Quantum Methods for Nonreactive Scattering. II. Quantum Mechanical Calculations of Rotational-Vibrational Scattering in Homonuclear Diatom-Atom Collisions. III. The Effect of the Potential Well on Vibrational Scattering and the Validity of SSH Theory. Dissertation (Ph.D.), California Institute of Technology (1972).

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Parents

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B. Vincent McKoy grad student 1972 Caltech
 (I. The Classification of Exact Quantum Methods for Nonreactive Scattering. II. Quantum Mechanical Calculations of Rotational-Vibrational Scattering in Homonuclear Diatom-Atom Collisions. III. The Effect of the Potential Well on Vibrational Scattering and )
Arnold Christian Wahl post-doc 1972-1974 Argonne National Laboratory

Children

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Khatuna Kakhiani post-doc Argonne National Laboratory, University of Chicago
Murat Keceli post-doc 2014-2018 Argonne National Laboratory

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Rivera-Rivera LA, Wagner AF, Perry JW. (2019) Normal mode analysis on the relaxation of an excited nitromethane molecule in argon bath. The Journal of Chemical Physics. 151: 034303
Chitsazi R, Wagner AF. (2019) Pressure effects on the vibrational and rotational relaxation of vibrationally excited OH (ν, J) in an argon bath. The Journal of Chemical Physics. 150: 114303
Keçeli M, Corsetti F, Campos C, et al. (2018) SIESTA-SIPs: Massively parallel spectrum-slicing eigensolver for an ab initio molecular dynamics package. Journal of Computational Chemistry. 39: 1806-1814
Jasper AW, Gruey ZB, Harding LB, et al. (2018) Anharmonic Rovibrational Partition Functions for Fluxional Species at High Temperatures via Monte Carlo Phase Space Integrals. The Journal of Physical Chemistry. A
Fang Z, Both J, Li S, et al. (2016) Benchmark Calculations of Energetic Properties of Groups 4 and 6 Transition Metal Oxide Nanoclusters Including Comparison to Density Functional Theory. Journal of Chemical Theory and Computation
Keçeli M, Zhang H, Zapol P, et al. (2015) Shift-and-invert parallel spectral transformation eigensolver: Massively parallel performance for density-functional based tight-binding. Journal of Computational Chemistry
Rivera-Rivera LA, Wagner AF, Sewell TD, et al. (2015) Pressure effects on the relaxation of an excited nitromethane molecule in an argon bath. The Journal of Chemical Physics. 142: 014303
Wagner AF, Dawes R, Continetti RE, et al. (2014) Theoretical/experimental comparison of deep tunneling decay of quasi-bound H(D)OCO to H(D) + CO₂. The Journal of Chemical Physics. 141: 054304
Wagner AF. (2013) Improved multidimensional semiclassical tunneling theory. The Journal of Physical Chemistry. A. 117: 13089-100
Perry JW, Dawes R, Wagner AF, et al. (2013) A classical trajectory study of the intramolecular dynamics, isomerization, and unimolecular dissociation of HO2. The Journal of Chemical Physics. 139: 084319
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