Dmitri Babikov

Publication Activity (10 Years)

Years Active: 2018-2024
Publications (10 Years): 22

Top Topics

Molecular Dynamics Simulations

Hydrogen Peroxide

Energy Transfer

Top Venues

Faraday discussions

Physical chemistry chemical physics : PCCP

The journal of physical chemistry. A

The journal of physical chemistry letters

This page only lists publications with an associated author ORCID identifier.

Publications

Carolin Joy, Bikramaditya Mandal, Dulat Bostan, Marie-Lise Dubernet, Dmitri Babikov
Mixed quantum/classical theory (MQCT) approach to the dynamics of molecule-molecule collisions in complex systems. Faraday discussions 251 (0) (2024)
Dmitri Babikov, Nadia Balucani, Astrid Bergeat, Mark Brouard, David W Chandler, Matthew L Costen, Michal Fárník, Hua Guo, Tibor Győri, Dwayne Heard, David Heathcote, Nils Hertl, Pablo G Jambrina, Nathanael M Kidwell, Olivia A Krohn, Duc Viet Le, Jérôme Loreau, Stuart R Mackenzie, Max McCrea, Kenneth G McKendrick, Jennifer Meyer, Daniel R Moon, Amy S Mullin, Gilbert S Nathanson, Daniel M Neumark, Kang-Kuen Ni, Martin J Paterson, Eva Pluhařová, Patrick Robertson, Christopher Reilly, George C Schatz, Chris Sparling, Arthur G Suits, Peter D Watson, Roland Wester, Stefan Willitsch, Alec M Wodtke
Scattering of larger molecules - part 1: general discussion. Faraday discussions (2024)
Dmitri Babikov, Nadia Balucani, Astrid Bergeat, Mark Brouard, David W Chandler, Matthew L Costen, Michal Fárník, Hua Guo, Tibor Győri, Dwayne Heard, David Heathcote, Nils Hertl, Pablo G Jambrina, Nathanael M Kidwell, Olivia A Krohn, Duc Viet Le, Jérôme Loreau, Stuart R Mackenzie, Max McCrea, Kenneth G McKendrick, Jennifer Meyer, Daniel R Moon, Amy S Mullin, Gilbert S Nathanson, Daniel M Neumark, Kang-Kuen Ni, Martin J Paterson, Eva Pluhařová, Patrick Robertson, Christopher Reilly, George C Schatz, Chris Sparling, Arthur G Suits, Peter D Watson, Roland Wester, Stefan Willitsch, Alec M Wodtke
Scattering of larger molecules - part 1: general discussion. Faraday discussions 251 (0) (2024)
Dulat Bostan, Bikramaditya Mandal, Carolin Joy, Michał Żółtowski, Francois Lique, Jerome Loreau, Ernesto Quintas Sánchez, Adrian Batista-Planas, Richard Dawes, Dmitri Babikov
Mixed quantum/classical calculations of rotationally inelastic scattering in the CO + CO system: a comparison with fully quantum results. Physical chemistry chemical physics : PCCP 26 (8) (2024)
Carolin Joy, Bikramaditya Mandal, Dulat Bostan, Marie-Lise Dubernet, Dmitri Babikov
Mixed quantum/classical theory (MQCT) approach to the dynamics of molecule-molecule collisions in complex systems. Faraday discussions 251 (0) (2024)
Dmitri Babikov, Nadia Balucani, Astrid Bergeat, Mark Brouard, David W Chandler, Matthew L Costen, Michal Fárník, Hua Guo, Tibor Győri, Dwayne Heard, David Heathcote, Nils Hertl, Pablo G Jambrina, Nathanael M Kidwell, Olivia A Krohn, Duc Viet Le, Jérôme Loreau, Stuart R Mackenzie, Max McCrea, Kenneth G McKendrick, Jennifer Meyer, Daniel R Moon, Amy S Mullin, Gilbert S Nathanson, Daniel M Neumark, Kang-Kuen Ni, Martin J Paterson, Eva Pluhařová, Patrick Robertson, Christopher Reilly, George C Schatz, Chris Sparling, Arthur G Suits, Peter D Watson, Roland Wester, Stefan Willitsch, Alec M Wodtke
Scattering of larger molecules - part 1: general discussion. Faraday discussions 251 (0) (2024)
Carolin Joy, Bikramaditya Mandal, Dulat Bostan, Marie-Lise Dubernet, Dmitri Babikov
Mixed quantum/classical theory (MQCT) approach to the dynamics of molecule-molecule collisions in complex systems. Faraday discussions (2024)
Dulat Bostan, Bikramaditya Mandal, Carolin Joy, Michał Żółtowski, Francois Lique, Jerome Loreau, Ernesto Quintas Sánchez, Adrian Batista-Planas, Richard Dawes, Dmitri Babikov
Mixed quantum/classical calculations of rotationally inelastic scattering in the CO + CO system: a comparison with fully quantum results. Physical chemistry chemical physics : PCCP 26 (8) (2024)
Dulat Bostan, Bikramaditya Mandal, Carolin Joy, Michał Żółtowski, Francois Lique, Jerome Loreau, Ernesto Quintas Sánchez, Adrian Batista-Planas, Richard Dawes, Dmitri Babikov
Mixed quantum/classical calculations of rotationally inelastic scattering in the CO + CO system: a comparison with fully quantum results. Physical chemistry chemical physics : PCCP (2023)
Bikramaditya Mandal, Carolin Joy, Dulat Bostan, Alexander Eng, Dmitri Babikov
Adiabatic Trajectory Approximation: A New General Method in the Toolbox of Mixed Quantum/Classical Theory for Collisional Energy Transfer. The journal of physical chemistry letters 14 (3) (2023)
Bikramaditya Mandal, Carolin Joy, Dulat Bostan, Alexander Eng, Dmitri Babikov
Adiabatic Trajectory Approximation: A New General Method in the Toolbox of Mixed Quantum/Classical Theory for Collisional Energy Transfer. The journal of physical chemistry letters (2023)
Dulat Bostan, Bikramaditya Mandal, Carolin Joy, Dmitri Babikov
Description of quantum interference using mixed quantum/classical theory of inelastic scattering. Physical chemistry chemical physics : PCCP (2023)
Carolin Joy, Bikramaditya Mandal, Dulat Bostan, Dmitri Babikov
Mixed quantum/classical theory for rotational energy exchange in symmetric-top-rotor + linear-rotor collisions and a case study of the ND 3 + D 2 system. Physical chemistry chemical physics : PCCP (2023)
Kayla Imanzi, Dulat Bostan, Max McCrea, Josh Featherstone, Mark Brouard, Dmitri Babikov
Symmetry Breaking: A Classic Example of Quantum Interference Captured by Mixed Quantum/Classical Theory. The journal of physical chemistry letters (2023)
Peng Liu, Jingjun Liu, Aoshuang Ji, Christopher T Reinhard, Noah J Planavsky, Dmitri Babikov, Raymond G Najjar, James F Kasting
Triple oxygen isotope constraints on atmospheric O 2 and biological productivity during the mid-Proterozoic. Proceedings of the National Academy of Sciences of the United States of America 118 (51) (2022)
Dmitri Babikov, Elizaveta Grushnikova, Igor Gayday, Alexander Teplukhin
Four Isotope-Labeled Recombination Pathways of Ozone Formation. Molecules (Basel, Switzerland) 26 (5) (2021)
Igor Gayday, Dmitri Babikov
Efficient Method for an Approximate Treatment of the Coriolis Effect in Calculations of Quantum Dynamics and Spectroscopy, with Application to Scattering Resonances in Ozone. The journal of physical chemistry. A 125 (25) (2021)
Igor Gayday, Alexander Teplukhin, Brian K Kendrick, Dmitri Babikov
Theoretical Treatment of the Coriolis Effect Using Hyperspherical Coordinates, with Application to the Ro-Vibrational Spectrum of Ozone. The journal of physical chemistry. A 124 (14) (2020)
Bikramaditya Mandal, Alexander Semenov, Dmitri Babikov
Adiabatic Trajectory Approximation within the Framework of Mixed Quantum/Classical Theory. The journal of physical chemistry. A 124 (47) (2020)
Igor Gayday, Alexander Teplukhin, Dmitri Babikov
The ratio of the number of states in asymmetric and symmetric ozone molecules deviates from the statistical value of 2. The Journal of chemical physics 150 (10) (2019)
Alexander Teplukhin, Brian K Kendrick, Dmitri Babikov
Calculation of Molecular Vibrational Spectra on a Quantum Annealer. Journal of chemical theory and computation 15 (8) (2019)
Alexander Teplukhin, Dmitri Babikov
Several Levels of Theory for Description of Isotope Effects in Ozone: Symmetry Effect and Mass Effect. The journal of physical chemistry. A 122 (47) (2018)