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Predicting binding energies of astrochemically relevant molecules via machine learning
2022
Astronomy and Astrophysics
Context. The behaviour of molecules in space is to a large extent governed by where they freeze out or sublimate. The molecular binding energy is therefore an important parameter for many astrochemical studies. This parameter is usually determined with timeconsuming experiments, computationally expensive quantum chemical calculations, or the inexpensive yet relatively inaccurate linear addition method. Aims. In this work, we propose a new method for predicting binding energies (BEs) based on
doi:10.1051/0004-6361/202244091
fatcat:a4fgxfl4vzdipaqggvjbf2zqna