3 papers
physics.chem-ph2024
Theoretical study of the excitation function in the CN + C2H6 hydrogen transfer reaction. Effect of vibrational excitation
Joaquin Espinosa-Garcia, Cipriano Rangel, Jose C. Corchado
To gain insight into the dynamics of the CN + C2H6 gas-phase reaction, quasi-classical trajectory (QCT) calculations were performed on a full-dimensional analytical potential energ…
physics.chem-ph2023
QCT study of the vibrational and translational role in the CN(v) + C2H6(ν1, ν2, ν5 and ν9) reactions
Joaquin Espinosa-Garcia, Cipriano Rangel, Jose C. Corchado
Quasi-classical trajectory (QCT) calculations were conducted on the newly developed full-dimensional potential energy surface, PES-2023, to analyse two critical aspects: the influe…
astro-ph.GA2023
A sequential acid-base (SAB) mechanism in the interstellar medium: The emergence of cis formic acid in dark molecular clouds
Juan García de la Concepción, Izaskun Jiménez-Serra, José Carlos Corchado +5
The abundance ratios between isomers of a COM observed in the ISM provides valuable information about the chemistry and physics of the gas and eventually, the history of molecular…