Year |
Citation |
Score |
2023 |
Pan H, Zhao B, Guo H, Liu K. State-to-State Dynamics in Mode-Selective Polyatomic Reactions. The Journal of Physical Chemistry Letters. 10412-10419. PMID 37955874 DOI: 10.1021/acs.jpclett.3c02853 |
0.502 |
|
2022 |
Han S, Zhao B, Conte R, Malbon CL, Bowman JM, Yarkony DR, Guo H. Nonadiabatic Reactive Quenching of OH(Σ) by H: Origin of High Vibrational Excitation in the HO Product. The Journal of Physical Chemistry. A. PMID 36137233 DOI: 10.1021/acs.jpca.2c05704 |
0.766 |
|
2022 |
Ellerbrock R, Zhao B, Manthe U. Vibrational control of the reaction pathway in the H + CHD → H + CD reaction. Science Advances. 8: eabm9820. PMID 35353570 DOI: 10.1126/sciadv.abm9820 |
0.658 |
|
2021 |
Zhao B, Han S, Malbon CL, Manthe U, Yarkony DR, Guo H. Full-dimensional quantum stereodynamics of the non-adiabatic quenching of OH(AΣ) by H. Nature Chemistry. PMID 34373597 DOI: 10.1038/s41557-021-00730-1 |
0.745 |
|
2021 |
Zhao B, Manthe U. Direct product-type grid representations for angular coordinates in extended space and their application in the MCTDH approach. The Journal of Chemical Physics. 154: 104115. PMID 33722051 DOI: 10.1063/5.0045054 |
0.569 |
|
2020 |
Zhao B, Manthe U. Eight-Dimensional Wave Packet Dynamics Within the Quantum Transition-State Framework: State-to-State Reactive Scattering for H + CH ⇆ H + CH. The Journal of Physical Chemistry. A. PMID 33124418 DOI: 10.1021/acs.jpca.0c08461 |
0.633 |
|
2020 |
Li J, Zhao B, Xie D, Guo H. Advances and New Challenges to Bimolecular Reaction Dynamics Theory. The Journal of Physical Chemistry Letters. PMID 32970441 DOI: 10.1021/acs.jpclett.0c02501 |
0.376 |
|
2020 |
Zhao B, Manthe U. Non-adiabatic transitions in the reaction of fluorine with methane. The Journal of Chemical Physics. 152: 231102. PMID 32571073 DOI: 10.1063/5.0013852 |
0.603 |
|
2020 |
Malbon CL, Zhao B, Guo H, Yarkony DR. On the nonadiabatic collisional quenching of OH(A) by H: a four coupled quasi-diabatic state description. Physical Chemistry Chemical Physics : Pccp. PMID 32538422 DOI: 10.1039/D0Cp01754J |
0.526 |
|
2020 |
Lin Q, Zhang Y, Zhao B, Jiang B. Automatically growing global reactive neural network potential energy surfaces: A trajectory-free active learning strategy. The Journal of Chemical Physics. 152: 154104. PMID 32321263 DOI: 10.1063/5.0004944 |
0.318 |
|
2019 |
Xie C, Zhao B, Malbon CL, Yarkony DR, Xie D, Guo H. Insights into the Mechanism of Nonadiabatic Photodissociation from Product Vibrational Distributions. The Remarkable Case of Phenol. The Journal of Physical Chemistry Letters. PMID 31821757 DOI: 10.1021/Acs.Jpclett.9B03407 |
0.534 |
|
2019 |
Zhao B, Manthe U. Counter-propagating wave packets in the quantum transition state approach to reactive scattering. The Journal of Chemical Physics. 150: 184103. PMID 31091929 DOI: 10.1063/1.5097997 |
0.656 |
|
2018 |
Zhao B, Manthe U, Guo H. Fermi resonance controlled product branching in the H + HOD reaction. Physical Chemistry Chemical Physics : Pccp. PMID 29911229 DOI: 10.1039/C8Cp02279H |
0.71 |
|
2018 |
Schäpers D, Zhao B, Manthe U. Coordinate systems and kinetic energy operators for multi-configurational time-dependent Hartree calculations studying reactions of methane Chemical Physics. 509: 37-44. DOI: 10.1016/J.Chemphys.2018.02.025 |
0.613 |
|
2017 |
Zhao B, Sun Z, Guo H. State-to-state mode specificity in H + DOH(νOH = 1) → HD + OH(ν2 = 0) reaction: vibrational non-adiabaticity or local-mode excitation? Physical Chemistry Chemical Physics : Pccp. 20: 191-198. PMID 29184926 DOI: 10.1039/C7Cp07199J |
0.579 |
|
2017 |
Zhao B, Manthe U. A transition-state based rotational sudden (TSRS) approximation for polyatomic reactive scattering. The Journal of Chemical Physics. 147: 144104. PMID 29031274 DOI: 10.1063/1.5003226 |
0.665 |
|
2017 |
Zuo J, Zhao B, Guo H, Xie D. A global coupled cluster potential energy surface for HCl + OH ↔ Cl + H2O. Physical Chemistry Chemical Physics : Pccp. PMID 28327711 DOI: 10.1039/C7Cp00920H |
0.533 |
|
2017 |
Kolb B, Marshall P, Zhao B, Jiang B, Guo H. Representing Global Reactive Potential Energy Surfaces Using Gaussian Processes. The Journal of Physical Chemistry. A. PMID 28287725 DOI: 10.1021/Acs.Jpca.7B01182 |
0.496 |
|
2017 |
Zhao B, Guo H. State-to-state quantum reactive scattering in four-atom systems Wiley Interdisciplinary Reviews: Computational Molecular Science. 7: e1301. DOI: 10.1002/Wcms.1301 |
0.537 |
|
2016 |
Zhao B, Sun Z, Guo H. A reactant-coordinate-based approach to state-to-state differential cross sections for tetratomic reactions. The Journal of Chemical Physics. 145: 184106. PMID 27846704 DOI: 10.1063/1.4966966 |
0.564 |
|
2016 |
Zhao B, Sun Z, Guo H. State-to-state differential cross sections for D2 + OH → D + DOH reaction: Influence of vibrational excitation of OH reactant. The Journal of Chemical Physics. 145: 134308. PMID 27782444 DOI: 10.1063/1.4964322 |
0.587 |
|
2016 |
Kolb B, Zhao B, Li J, Jiang B, Guo H. Permutation invariant potential energy surfaces for polyatomic reactions using atomistic neural networks. The Journal of Chemical Physics. 144: 224103. PMID 27305992 DOI: 10.1063/1.4953560 |
0.477 |
|
2016 |
Zhao B, Sun Z, Guo H. State-to-state mode selectivity in the HD + OH reaction: Perspectives from two product channels. The Journal of Chemical Physics. 144: 214303. PMID 27276953 DOI: 10.1063/1.4952764 |
0.581 |
|
2016 |
Zhao B, Sun Z, Guo H. A reactant-coordinate-based wave packet method for full-dimensional state-to-state quantum dynamics of tetra-atomic reactions: Application to both the abstraction and exchange channels in the H + H2O reaction. The Journal of Chemical Physics. 144: 064104. PMID 26874479 DOI: 10.1063/1.4941671 |
0.558 |
|
2016 |
Wu YC, Zhao B, Lee SY. Time-dependent wave packet averaged vibrational frequencies from femtosecond stimulated Raman spectra. The Journal of Chemical Physics. 144: 054104. PMID 26851905 DOI: 10.1063/1.4941057 |
0.72 |
|
2015 |
Zhao B, Sun Z, Guo H. State-to-state Mode Specificity: Energy Sequestration and Flow Gated by Transition State. Journal of the American Chemical Society. PMID 26613942 DOI: 10.1021/Jacs.5B11404 |
0.595 |
|
2015 |
Zhao B, Guo H. Modulations of Transition-State Control of State-to-State Dynamics in the F + H2O → HF + OH Reaction. The Journal of Physical Chemistry Letters. 6: 676-80. PMID 26262484 DOI: 10.1021/Acs.Jpclett.5B00071 |
0.584 |
|
2015 |
Zhao B, Sun Z, Guo H. Communication: State-to-state dynamics of the Cl + H2O → HCl + OH reaction: Energy flow into reaction coordinate and transition-state control of product energy disposal. The Journal of Chemical Physics. 142: 241101. PMID 26133401 DOI: 10.1063/1.4922650 |
0.592 |
|
2015 |
Li J, Jiang B, Song H, Ma J, Zhao B, Dawes R, Guo H. From ab Initio Potential Energy Surfaces to State-Resolved Reactivities: X + H2O ↔ HX + OH [X = F, Cl, and O((3)P)] Reactions. The Journal of Physical Chemistry. A. 119: 4667-87. PMID 25886142 DOI: 10.1021/Acs.Jpca.5B02510 |
0.498 |
|
2014 |
Zhao B, Sun Z, Guo H. Calculation of the state-to-state S-matrix for tetra-atomic reactions with transition-state wave packets: H₂/D₂ + OH → H/D + H₂O/HOD. The Journal of Chemical Physics. 141: 154112. PMID 25338886 DOI: 10.1063/1.4898100 |
0.573 |
|
2014 |
Zhao B, Sun Z, Guo H. Calculation of state-to-state differential and integral cross sections for atom-diatom reactions with transition-state wave packets. The Journal of Chemical Physics. 140: 234110. PMID 24952526 DOI: 10.1063/1.4883615 |
0.554 |
|
2014 |
Zhao B, Zhang DH, Lee SY, Sun Z. Calculation of state-to-state cross sections for triatomic reaction by the multi-configuration time-dependent Hartree method. The Journal of Chemical Physics. 140: 164108. PMID 24784254 DOI: 10.1063/1.4872157 |
0.752 |
|
2011 |
Zhao B, Sun Z, Lee SY. Quantum theory of time-resolved femtosecond stimulated Raman spectroscopy: direct versus cascade processes and application to CDCl3. The Journal of Chemical Physics. 134: 024307. PMID 21241099 DOI: 10.1063/1.3525100 |
0.355 |
|
2011 |
Zhao B, Niu K, Li X, Lee S. Simple aspects of femtosecond stimulated Raman spectroscopy Science China Chemistry. 54: 1989-2008. DOI: 10.1007/S11426-011-4430-8 |
0.719 |
|
2010 |
Niu K, Zhao B, Sun Z, Lee SY. Analysis of femtosecond stimulated Raman spectroscopy of excited-state evolution in bacteriorhodopsin. The Journal of Chemical Physics. 132: 084510. PMID 20192310 DOI: 10.1063/1.3330818 |
0.407 |
|
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