1 |
Crossover from hydrogen to chemical bonding Dereka B, Yu Q, Lewis NHC, Carpenter WB, Bowman JM, Tokmakoff A Science, 371(6525), 160, 2021 |
2 |
Tracking Hydronium/Water Stretches in Magic H3O+(H2O)(20) Clusters through High-level Quantum VSCF/VCI Calculations Yu Q, Bowman JM Journal of Physical Chemistry A, 124(6), 1167, 2020 |
3 |
A Machine Learning Approach for Rate Constants. II. Clustering, Training, and Predictions for the O(P-3) + HCl -> OH plus Cl Reaction Nandi A, Bowman JM, Houston P Journal of Physical Chemistry A, 124(28), 5746, 2020 |
4 |
Capturing roaming molecular fragments in real time Endo T, Neville SP, Wanie V, Beaulieu S, Qu C, Deschamps J, Lassonde P, Schmidt BE, Fujise H, Fushitani M, Hishikawa A, Houston PL, Bowman JM, Schuurman MS, Legare F, Ibrahim H Science, 370(6520), 1072, 2020 |
5 |
Rotational resonances in the H2CO roaming reaction are revealed by detailed correlations Quinn MS, Nauta K, Jordan MJT, Bowman JM, Houston PL, Kable SH Science, 369(6511), 1592, 2020 |
6 |
Classical, Thermostated Ring Polymer, and Quantum VSCF/VCI Calculations of IR Spectra of H7O3+ and H9O4+ (Eigen) and Comparison with Experiment Published as part of The Journal of Physical Chemistry virtual special issue "Hanna Reisler Festschrift" Yu Q, Bowman JM Journal of Physical Chemistry A, 123(7), 1399, 2019 |
7 |
Assessing the Importance of the H-2-H2O-H2O Three-Body Interaction on the Vibrational Frequency Shift of H-2 in the sII Clathrate Hydrate and Comparison with Experiment Qu C, Bowman JM Journal of Physical Chemistry A, 123(1), 329, 2019 |
8 |
Disentangling the Complex Vibrational Mechanics of the Protonated Water Trimer by Rational Control of Its Hydrogen Bonds Duong CH, Yang N, Johnson MA, DiRisio RJ, McCoy AB, Yu Q, Bowman JM Journal of Physical Chemistry A, 123(37), 7965, 2019 |
9 |
H atom Product Channels in the Ultraviolet Photodissociation of the 2-Propenyl Radical Sun G, Lucas M, Song Y, Zhang JS, Brazier C, Houston PL, Bowman JM Journal of Physical Chemistry A, 123(46), 9957, 2019 |
10 |
High-Level VSCF/VCI Calculations Decode the Vibrational Spectrum of the Aqueous Proton Yu Q, Carpenter WB, Lewis NHC, Tokrnakoff A, Bowman JM Journal of Physical Chemistry B, 123(33), 7214, 2019 |