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neglected entropic effects

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Category: Physical Chemistry

Thermodynamics of molecular binding and clustering in the atmosphere revealed through conventional and ML-enhanced umbrella sampling

, Authors: Jakub Kubečka, Yosef Knattrup, Georg Baadsgaard Trolle, Bernhard Reischl, August Smart Lykke-Møller, Jonas Elm, Ivo Neefjes

Version 1 posted 13 June 2025

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ISSN 2573-2293 (Online) ChemRxiv Archive

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