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Automated potential energy surface development and quasi-classical dynamics for the F− + SiH3I system

The Journal of Chemical Physics
2024-11-21 | Journal article
DOI: 10.1063/5.0238366
Contributors: Balázs J. Molnár; Attila Á. Dékány; Gábor Czakó
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Exploring the versatile reactivity of the F− + SiH3Cl system on a full-dimensional coupled-cluster potential energy surface

The Journal of Chemical Physics
2023-06-14 | Journal article
DOI: 10.1063/5.0153083
Contributors: Attila Á. Dékány; Gábor Czakó
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