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Emília Valença Ferreira de Aragão

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2020 – today

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2024
[c12]
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Luca Mancini, Emília Valença Ferreira de Aragão, Fernando Pirani, Marzio Rosi, Noelia Faginas Lago, Daniela Ascenzi:
The rmHe^+. + rmCH_3rmCN Charge-Exchange Reaction: A Combined Semi-empirical and Quantum Chemical Study. ICCSA (4) 2024: 39-54
2023
[c11]
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Noelia Faginas Lago, Emília Valença Ferreira de Aragão, Luca Mancini, Marzio Rosi, Daniela Ascenzi, Fernando Pirani:
Coding Cross Sections of an Electron Charge Transfer Process: Analysis of Different Cuts for the Entrance and Exit Potentials. ICCSA (Workshops 8) 2023: 162-175
[c10]
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Luca Mancini, Emília Valença Ferreira de Aragão, Marzio Rosi:
Computational Investigation of the N(²D)+ C₂H₄ and N(²D)+ CH₂CHCN Reactions: Benchmark Analysis and Implications for Titan's Atmosphere. ICCSA (Workshops 2) 2023: 705-717
2022
[c9]
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Luca Mancini, Marco Trinari, Emília Valença Ferreira de Aragão, Marzio Rosi, Nadia Balucani:
The S⁺(⁴S)+SiH₂(¹A₁) Reaction: Toward the Synthesis of Interstellar SiS. ICCSA (Workshops 2) 2022: 233-245
[c8]
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Luca Mancini, Emília Valença Ferreira de Aragão, Gianmarco Vanuzzo:
A Theoretical Investigation of the Reactions of N(²D) and CN with Acrylonitrile and Implications for the Prebiotic Chemistry of Titan. ICCSA (Workshops 2) 2022: 246-259
[c7]
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Emília Valença Ferreira de Aragão, Luca Mancini, Xiao He, Noelia Faginas Lago, Marzio Rosi, Daniela Ascenzi, Fernando Pirani:
Coding Cross Sections of an Electron Charge Transfer Process. ICCSA (Workshops 6) 2022: 319-333
2021
[c6]
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Luca Mancini, Emília Valença Ferreira de Aragão:
A Computational Analysis of the Reaction of Atomic Oxygen O(³P) with Acrylonitrile. ICCSA (10) 2021: 339-350
[c5]
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Emília Valença Ferreira de Aragão, Luca Mancini, Noelia Faginas Lago, Marzio Rosi, Nadia Balucani, Fernando Pirani:
Long-Range Complex in the HC₃N + CN Potential Energy Surface: Ab Initio Calculations and Intermolecular Potential. ICCSA (10) 2021: 413-425
[c4]
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  - conf/iccsa/LombardiMAG21
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Andrea Lombardi, Luca Mancini, Emília Valença Ferreira de Aragão, Lisa Giani:
The CH₂CH₂ + OH Gas Phase Reaction: Formaldehyde and Acetaldehyde Formation Routes. ICCSA (5) 2021: 581-593
2020
[c3]
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Emília Valença Ferreira de Aragão, Noelia Faginas Lago, Yusuf Bramastya Apriliyanto, Andrea Lombardi:
Gas Adsorption on Graphtriyne Membrane: Impact of the Induction Interaction Term on the Computational Cost. ICCSA (7) 2020: 513-525
[c2]
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Emília Valença Ferreira de Aragão, Noelia Faginas Lago, Marzio Rosi, Luca Mancini, Nadia Balucani, Dimitrios Skouteris:
A Computational Study of the Reaction Cyanoacetylene and Cyano Radical Leading to 2-Butynedinitrile and Hydrogen Radical. ICCSA (3) 2020: 707-716
[c1]
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Luca Mancini, Emília Valença Ferreira de Aragão, Marzio Rosi, Dimitrios Skouteris, Nadia Balucani:
A Theoretical Investigation of the Reactions of N(²D) with Small Alkynes and Implications for the Prebiotic Chemistry of Titan. ICCSA (3) 2020: 717-729

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