#quantumchemistry — Public Fediverse posts
Live and recent posts from across the Fediverse tagged #quantumchemistry, aggregated by home.social.
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"This measured value agrees with quantum tunnelling calculations, serving as a benchmark for molecular theory and advancing the understanding of fundamental collision processes. A deviation of the reaction rate from linear scaling, which is observed at high H2 densities, can be traced back to previously unobserved heating dynamics in radiofrequency ion traps."
https://www.nature.com/articles/s41586-023-05727-z#:~:text=This%20measured%20value,radiofrequency%20ion%20traps.#quantumChemistry #chemicalReactions #kinetics #computationalChemistry #quantumTunneling