Referred Publications

2024 (10 papers)



















2023 (25 papers)














Long-Range Complex in the HC3N + CN Potential Energy Surface: Ab Initio Calculations and Intermolecular Potential. Computational Science and Its Applications


2021, ICCSA 2021. ICCSA 2021. Lecture Notes in Computer Science, 12958



Combined crossed-beams and theoretical study of the O(3P, 1D) + acrylonitrile (CH2CHCN) reactions and implications for combustion and extraterrestrial environments


2023, Physical Chemistry Chemical Physics, 25,  20194-20211



Reaction N(2D) + CH2CCH2 (Allene): An Experimental and Theoretical Investigation and Implications for the Photochemical Models of Titan


2022, ACS Earth and Space Chemistry, 6, 2305–2321



Reactions O(3P, 1D) + HCCCN(X 1Σ+) (Cyanoacetylene): Crossed-Beam and Theoretical Studies and Implications for the Chemistry of Extraterrestrial Environments.


2023, The Journal of Physical Chemistry A, 127, 685–703


 





OH(2Π) + C2H4 Reaction: A Combined Crossed Molecular Beam and Theoretical Study


2023, The Journal of Physical Chemistry A, 127,  4609–4623









2022 (48 papers)


 








A Theoretical Investigation of the Reactions of N (2D) and CN with Acrylonitrile and Implications for the Prebiotic Chemistry of Titan


In: Gervasi, O., Murgante, B., Misra, S., Rocha, A.M.A.C., Garau, C. (eds) Computational Science and Its Applications – ICCSA 2022 Workshops, Lecture Notes in Computer Science, vol 13378



The S+(4S) + SiH2(1A1) Reaction: Toward the Synthesis of Interstellar SiS


In: Gervasi, O., Murgante, B., Misra, S., Rocha, A.M.A.C., Garau, C. (eds) Computational Science and Its Applications – ICCSA 2022 Workshops, Lecture Notes in Computer Science, vol 13378



Fragmentation of interstellar methanol by collisions with He+: an experimental and computational study


2022, Physical Chemistry Chemical Physics, 24(37), 22437-22452



Parametric amplification via superconducting contacts in a Ka band niobium pillbox cavity


2022, Journal of Low Temperature Physics, pp.1-8.





MNRAS 2022, 515, 543



PROTOSTAR & PLANETS VII - 2022, in press



The Journal of Physical Chemistry 2022, in press


Molecular Physics 2022, in press




ACS Earth Space Chem. 2022, in press



ACS Earth Space Chem. 2022, in press



https://www.mdpi.com/1420-3049/27/7/229



ACS Earth Space Chem. 2022, 6, 3, 597–630






https://www.mdpi.com/1420-3049/27/7/2297



2022A&A...658A.131Z




2022ApJ...927...54O




2022ApJ...927..203K



2022A&A...657A..78C



2022MNRAS.tmp..124D



The Reaction N(2D) + CH2CHCN (Vinyl Cyanide): A Combined Crossed Molecular Beams and Theoretical Study and Implications for the Atmosphere of Titan


2022, The Journal of Physical Chemistry A, 126, 6110-6123



2022A&A...658A..85R



2022A&A...657.136E



2022A&A...659A..67M

2021 (23 papers)








The Journal of Physical Chemistry A, 125, 2021


Frontiers Astronomy and Space Sciences 

2021FrASS...8..227C





2021A&A...654A..52C


2021ApJS..256...35T



Computing Binding Energies of Interstellar Molecules by Semiempirical Quantum Methods: Comparison Between DFT and GFN2 on Crystalline Ice


Lecture Notes in Computer Science, 2021, 632-645



The CH2CH2 + OH Gas Phase Reaction: Formaldehyde and Acetaldehyde Formation Routes


2021,  ICCSA Lecture Notes in Computer Science, vol 12953



Long-Range Complex in the HC3N + CN Potential Energy Surface: Ab Initio Calculations and Intermolecular Potential. Computational Science and Its Applications


2021, ICCSA 2021. ICCSA 2021. Lecture Notes in Computer Science, 12958





The reactivity of methanimine radical cation (H2CNH•+) and its isomer aminomethylene (HCNH2•+) with C2H4









2020 (17 papers)








In: Gervasi O. et al. (eds) Computational Science and Its Applications – ICCSA 2020. ICCSA 2020. Lecture Notes in Computer Science, vol 12251. Springer, Cham. https://doi.org/10.1007/978-3-030-58808-3_51


7. Valença Ferreira de Aragão, E., Faginas-Lago, N., Rosi, M., and 2 more 

Gas Adsorption on Graphtriyne Membrane: Impact of the Induction Interaction Term on the Computational Cost

In: Gervasi O. et al. (eds) Computational Science and Its Applications – ICCSA 2020. ICCSA 2020. Lecture Notes in Computer Science, vol 12251. Springer, Cham. https://link.springer.com/chapter/10.1007/978-3-030-58820-5_38


8. Heyl, J.,  Viti, S., Holdship, J., Feeney, S.M.


9. Podio, L., Garufi, A., Codella, C., and 8 more


10. Garufi, A.; Podio, L.; Codella, C., and 7 more


11. Pantaleone, S.; Enrique-Romero, J.; Ceccarelli, C., and 3 more


12. Taquet, V.; Codella, C.; De Simone, M., and 43 more


13.  Spezzano, S.; Codella, C.; Podio, L. and 4 more


14.  Enrique-Romero, J., Álvarez-Barcia, S., Kolb, F.J. and 7 more


15.  Bouvier, M., López-Sepulcre, A., Ceccarelli, C. and 5 more 


16. Germain, A.; Ugliengo, P.

https://link.springer.com/chapter/10.1007%2F978-3-030-58814-4_62


17. Bianchi, E.; Chandler, C. J.;  Ceccarelli, C.; Codella, C.; Sakai, N.; López-Sepulcre, A.; and 60 more

https://academic.oup.com/mnrasl/article-abstract/498/1/L87/5874261?redirectedFrom=fulltext

2019 (6 papers)


1.  Urso, R. G.; Palumbo, M. E.; Ceccarelli, C., and 16 more


2. Codella, C.; Ceccarelli, C.; Lee, C.-F.,  and 8 more


3. López-Sepulcre, A.; Balucani, N.; Ceccarelli, C., and 3 more


4. Taquet, V.; Bianchi, E.; Codella, C., and 7 more


5.  Bianchi, E.; Ceccarelli, C.; Codella, C., and 3 more


6. Enrique-Romero, J.; Rimola, A.; Ceccarelli, C.; Ugliengo, P.; Balucani, N.; Skouteris D.

https://pubs.acs.org/doi/10.1021/acsearthspacechem.9b00156