Publications

2026

1. PRA

   Wavepacket Dynamics and Quantum Scattering in Spin-Orbit Induced Excitation and Quenching in N⁺(³P)–He(¹S) and N⁺(¹D)–He(¹S) Collisions

   Tomáš Jíra, Åsa Larson, Lamia Aissaoui, and 1 more author

   Physical Review A, 2026

   DOI Bib HTML

   @article{10.1103/mgff-cjs8,
     title = {Wavepacket Dynamics and Quantum Scattering in Spin-Orbit Induced Excitation and Quenching in {N⁺(³P)–He(¹S)} and {N⁺(¹D)–He(¹S)} Collisions},
     author = {Jíra, Tomáš and Larson, Åsa and Aissaoui, Lamia and Buchowiecki, Marcin},
     journal = {Physical Review A},
     volume = {114},
     pages = {032805},
     year = {2026},
     doi = {10.1103/mgff-cjs8},
     url = {https://doi.org/10.1103/mgff-cjs8},
   }

2025

1. JCTC

   Critical Assessment of Curvature-Driven Surface Hopping Algorithms

   Tomáš Jíra, Jiří Janoš, and Petr Slavíček

   Journal of Chemical Theory and Computation, 2025

   DOI Bib HTML

   @article{10.1021/acs.jctc.5c01176,
     author = {Jíra, Tomáš and Janoš, Jiří and Slavíček, Petr},
     title = {Critical Assessment of Curvature-Driven Surface Hopping Algorithms},
     journal = {Journal of Chemical Theory and Computation},
     volume = {21},
     pages = {9784-9798},
     year = {2025},
     issn = {1549-9618},
     doi = {10.1021/acs.jctc.5c01176},
     url = {https://doi.org/10.1021/acs.jctc.5c01176},
   }

2. JQSRT

   Spin–Orbit Induced Charge Transfer in H⁺/D⁺/T⁺–N(⁴S) Collisions

   Marcin Buchowiecki and Tomáš Jíra

   Journal of Quantitative Spectroscopy and Radiative Transfer, 2025

   DOI Bib HTML

   @article{10.1016/j.jqsrt.2025.109697,
     author = {Buchowiecki, Marcin and Jíra, Tomáš},
     title = {Spin–Orbit Induced Charge Transfer in {H⁺/D⁺/T⁺–N(⁴S)} Collisions},
     journal = {Journal of Quantitative Spectroscopy and Radiative Transfer},
     volume = {347},
     pages = {109697},
     year = {2025},
     issn = {0022-4073},
     doi = {10.1016/j.jqsrt.2025.109697},
     url = {https://doi.org/10.1016/j.jqsrt.2025.109697},
   }

2024

1. JCTC

   Sensitivity Analysis in Photodynamics: How Does the Electronic Structure Control cis-Stilbene Photodynamics?

   Tomáš Jíra, Jiří Janoš, and Petr Slavíček

   Journal of Chemical Theory and Computation, 2024

   DOI Bib HTML

   @article{10.1021/acs.jctc.4c01008,
     author = {Jíra, Tomáš and Janoš, Jiří and Slavíček, Petr},
     title = {Sensitivity Analysis in Photodynamics: How Does the Electronic Structure Control <em>cis</em>-Stilbene Photodynamics?},
     journal = {Journal of Chemical Theory and Computation},
     volume = {20},
     pages = {10972-10985},
     year = {2024},
     issn = {1549-9618},
     doi = {10.1021/acs.jctc.4c01008},
     url = {https://doi.org/10.1021/acs.jctc.4c01008},
   }