140 citations · 299 across the 7 of their papers we have counts for
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physics.chem-ph2022
Quantum chemical computations of gas-phase glycolaldehyde deuteration and constraints to its formation route
F. Vazart, C. Ceccarelli, D. Skouteris +1
Despite the detection of numerous interstellar complex organic molecules (iCOMs) for decades, it is still a matter of debate whether they are synthesized in the gas-phase or on the…
physics.chem-ph2021★ 4 cited
A Computational Study of the Reaction Cyanoacetylene and Cyano Radical leading to 2-Butynedinitrile and Hydrogen Radical
Emília Valença Ferreira de Aragão, Noelia Faginas-Lago, Marzio Rosi +3
The present work focuses on the characterization of the reaction between cyanoacetylene and cyano radical by electronic structure calculations of the stationary points along the mi…