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The Journal of Physical Chemistry. A|October 10, 2009
Photoionization of three isomers of the C9H7 radicalPatrick Hemberger, Michael Steinbauer, Michael Schneider, et al.
The Journal of Physical Chemistry. A|April 11, 2025
NMR Crystallography Structure Determinations with 1H Chemical Shifts. GIPAW DFT Calculation Quality Can Be Substantially Degraded, but Nearly Identical Outputs Relative to Benchmark Computations Are Obtained: Why and So What?Cory M Widdifield, Navjot Kaur, Khoa Minh Nghi Nguyen
The Journal of Physical Chemistry. A|April 9, 2025
Thioflavin T Inspirations: On the Photophysical and Aggregation Properties of Fluorescent Difluoroborates Based on the Benzothiazole CorePatryk Rybczyński, Agata Hajda, Robert Zaleśny, et al.
The Journal of Physical Chemistry. A|April 9, 2025
Semiclassical Approach to Computing Vibrationally Resolved Ionization Cross Sections for Molecular NitrogenPaul E Adamson, Darryl J Watkins, Michael V Pak, et al.
The Journal of Physical Chemistry. A|April 2, 2025
Local Bond-Stretch Coordinates for Anharmonic Vibrational ComputationsSebastian Riis Thomsen, Nicolai Machholdt Høyer, Mads Greisen Højlund, et al.
The Journal of Physical Chemistry. A|April 2, 2025
Ionic Fragments and Clusters Produced by Electron Impact of Acetonitrile and Methanol Mixed Molecular FilmsWania Wolff, Andre M R Giraldi, Jorge H C Basilio, et al.
The Journal of Physical Chemistry. A|April 8, 2025
Computational Prediction of One-Electron Oxidation Potentials for Cytosine and Uracil Epigenetic DerivativesVasilii Korotenko, Patrick Langrzyk, Hendrik Zipse
The Journal of Physical Chemistry. A|April 4, 2025
Discrepancies between Theory and Experiment in Determining the Ionization Energy of NF3Megan R Bentley, Peter R Franke, Kaila E Weflen, et al.
The Journal of Physical Chemistry. A|April 7, 2025
Energetic and Electronic Properties of UX+/0/- for X = Li and Be and Comparison of the Properties of the Uranium Atom Binding to 2nd Row Elements Li-FJoão G F Romeu, Gabriel F de Melo, Kirk A Peterson, et al.
The Journal of Physical Chemistry. A|April 2, 2025
IR Spectroscopy of 4-Aminobenzonitrile+-Ar (n = 0-2): Determination of the Activation Barrier for the π → NH Site-Switching ReactionShino Yukumi, Otto Dopfer, Mitsuhiko Miyazaki
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