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Emília Valença Ferreira de Aragão
Emília Valença Ferreira de Aragão
University of Perugia
Potential energy surface
Ab initio
Materials science
Physical chemistry
Work (thermodynamics)
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The CH\(_2\)CH\(_2\) + OH Gas Phase Reaction: Formaldehyde and Acetaldehyde Formation Routes
2021
ICCSA | International Conference on Computational Science and Its Applications
Andrea Lombardi
Luca Mancini
Emília Valença Ferreira de Aragão
Lisa Giani
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A Computational Study of the Reaction Cyanoacetylene and Cyano Radical leading to 2-Butynedinitrile and Hydrogen Radical
2021
arXiv: Chemical Physics
Emília Valença Ferreira de Aragão
Noelia Faginas-Lago
Marzio Rosi
Luca Mancini
Nadia Balucani
Dimitrios Skouteris
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A Computational Analysis of the Reaction of Atomic Oxygen O( 3 P) with Acrylonitrile.
2021
ICCSA | International Conference on Computational Science and Its Applications
Luca Mancini
Emília Valença Ferreira de Aragão
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Long-Range Complex in the HC\(_{3}\)N + CN Potential Energy Surface: Ab Initio Calculations and Intermolecular Potential
2021
ICCSA | International Conference on Computational Science and Its Applications
Emília Valença Ferreira de Aragão
Luca Mancini
Noelia Faginas-Lago
Marzio Rosi
Nadia Balucani
Fernando Pirani
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