AstroChemical Origins

CORDIS provides links to public deliverables and publications of HORIZON projects.

Links to deliverables and publications from FP7 projects, as well as links to some specific result types such as dataset and software, are dynamically retrieved from OpenAIRE .

Deliverables

"Immersive Virtual Reality ""Astrochemistry and Star Formation"" exhibition"

Organise the Immersive Virtual Reality “Astrochemistry and Star Formation” exhibition

A&A Special issue publication

Organise publication of ACO works on a A&A Special Issue

Final conference

Organise the Final conference

Advertise ESRs vacancies

Advertise ESRs vacancies in web sites and to the astrochemistry community. The advertisements themselves will be submitted in this deliverable.

CHESS and ASAI spectra

make CHESS and ASAI spectra publicly available

Network web site

Build and publish the Network web site

Publications

Astrochemistry as a Tool To Follow Protostellar Evolution: The Class I Stage

Author(s): Eleonora Bianchi, Cecilia Ceccarelli, Claudio Codella, Juan Enrique-Romero, Cecile Favre, Bertrand Lefloch
Published in: ACS Earth and Space Chemistry, Issue 3/12, 2019, Page(s) 2659-2674, ISSN 2472-3452
Publisher: ACS Publications
DOI: 10.1021/acsearthspacechem.9b00158

ALMA chemical survey of disk-outflow sources in Taurus (ALMA-DOT). III. The interplay between gas and dust in the protoplanetary disk of DG Tau

Author(s): L. Podio, A. Garufi, C. Codella, D. Fedele, K. Rygl, C. Favre, F. Bacciotti, E. Bianchi, C. Ceccarelli, S. Mercimek, R. Teague, L. Testi
Published in: Astronomy & Astrophysics, Issue December 2020, 2020, ISSN 0004-6361
Publisher: Springer Verlag

Seeds of Life in Space (SOLIS) - VIII. SiO isotopic fractionation, and a new insight into the shocks of L1157-B1

Author(s): S. Spezzano, C. Codella, L. Podio, C. Ceccarelli, P. Caselli, R. Neri, A. López-Sepulcre
Published in: Astronomy & Astrophysics, Issue Volume 640 - A74, 2020, ISSN 0004-6361
Publisher: Springer Verlag

Water formation on interstellar silicates: the role of Fe2+/H2 interactions in the O + H2 → H2O reaction

Author(s): Albert Rimola; Christian Domínguez Dalmases; Marc Serra-Peralta
Published in: Physical Chemistry - Chemical Physics, Issue Issue 46, Phys. Chem. Chem. Phys., 2022,24, 28381-28393, 2022, ISSN 1463-9076
Publisher: Royal Society of Chemistry
DOI: 10.1039/d2cp04051d

Chemical Desorption versus Energy Dissipation: Insights from Ab Initio Molecular Dynamics of HCO· Formation

Author(s): Stefano Pantaleone, Joan Enrique-Romero, Cecilia Ceccarelli, Piero Ugliengo, Nadia Balucani, Albert Rimola
Published in: The Astrophysical Journal, Issue 897/1, 2020, Page(s) 56, ISSN 1538-4357
Publisher: The American Astronomical Society
DOI: 10.3847/1538-4357/ab8a4b

XVII. Jet candidate unveiled in OMC-2 and its possible link to the enhanced cosmic-ray ionisation rate

Author(s): V. Lattanzi; F. O. Alves; M. Padovani; F. Fontani; P. Caselli; C. Ceccarelli; A. López-Sepulcre; C. Favre; R. Neri; L. Chahine; C. Vastel; L. Evans
Published in: Astronomy & Astrophysics, Issue Volume 671, March 2023, 2023, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.1051/0004-6361/202142736

Theoretical Distribution of the Ammonia Binding Energy at Interstellar Icy Grains: A New Computational Framework

Author(s): Lorenzo Tinacci; Auréle Germain; Stefano Pantaleone; Stefano Ferrero; Cecilia Ceccarelli; Piero Ugliengo
Published in: ACS Earth and Space Chemistry, Issue 6-6, 2022, Page(s) 1514–1526, ISSN 2472-3452
Publisher: ACS Publications
DOI: 10.1021/acsearthspacechem.2c00040

The CALYPSO IRAM-PdBI survey of jets from Class 0 protostars

Author(s): L. Podio, B. Tabone, C. Codella, F. Gueth, A. Maury, S. Cabrit, B. Lefloch, S. Maret, A. Belloche, P. André, S. Anderl, M. Gaudel, L. Testi
Published in: Astronomy & Astrophysics, Issue 648, 2021, Page(s) A45, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.1051/0004-6361/202038429

ALMA chemical survey of disk-outflow sources in Taurus (ALMA-DOT) V: Sample, overview, and demography of disk molecular emission

Author(s): Antonio Garufi, Linda Podio, Claudio Codella, Davide Fedele, Eleonora Bianchi, Cecile Favre, Francesca Bacciotti, Cecilia Ceccarelli, Seyma Mercimek, Kazi Rygl, Richard Teague, Leonardo Testi
Published in: Astronomy & Astrophysics, Issue Volume 645, January 2021, 2021, ISSN 1432-0746
Publisher: EDP Science

II. Optical constants of CO and CO2 ices in the terahertz and infrared ranges

Author(s): A. A. Gavdush; F. Kruczkiewicz; B. M. Giuliano; B. Müller; G. A. Komandin; T. Grassi; P. Theulé; K. I. Zaytsev; A. V. Ivlev; P. Caselli
Published in: Astronomy and Astrophysics, Issue Volume 667, November 2022, 2022, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.1051/0004-6361/202244102

Revisiting the reactivity between HCO and CH3 on interstellar grain surfaces

Author(s): J Enrique-Romero, S Álvarez-Barcia, F J Kolb, A Rimola, C Ceccarelli, N Balucani, J Meisner, P Ugliengo, T Lamberts, J Kästner
Published in: Monthly Notices of the Royal Astronomical Society, Issue 493/2, 2020, Page(s) 2523-2527, ISSN 0035-8711
Publisher: Blackwell Publishing Inc.
DOI: 10.1093/mnras/staa484

FAUST V. Hot methanol in the [BHB2007] 11 protobinary system; hot corino versus shock origin

Author(s): C. Vastel, F. Alves, C. Ceccarelli, M. Bouvier, I. Jimenez-Serra, T. Sakai, P. Caselli, L. Evans, F. Fontani, R. Le Gal, C. J. Chandler, B. Svoboda, L. Maud, C. Codella, N. Sakai, A. Lopez-Sepulcre, G. Moellenbrock, Y. Aikawa, N. Balucani, E. Bianchi, G. Busquet, E. Caux, S. Charnley, N. Cuello, M. De Simone, F. Dulieu, A. Duran, D. Fedele, S. Feng, L. Francis, T. Hama, T. Hanawa, E. Herbst, T. Hi
Published in: Astronomy & Astrophysics, Issue Volume 664, August 2022 (A171), 2022, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.1051/0004-6361/202243414

Chemical exploration of Galactic cold cores

Author(s): Chenlin Zhou; Charlotte Vastel; Julien Montillaud; Cecilia Ceccarelli; Karine Demyk; Jorma Harju; Mika Juvela; Isabelle Ristorcelli; Tie Liu
Published in: Astronomy and Astrophysics, Issue Volume 658, February 2022, 2022, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.1051/0004-6361/202142408

Binding Energies of Interstellar Molecules on Crystalline and Amorphous Models of Water Ice by Ab Initio Calculations

Author(s): Stefano Ferrero, Lorenzo Zamirri, Cecilia Ceccarelli, Arezu Witzel, Albert Rimola, Piero Ugliengo
Published in: The Astrophysical Journal, Issue 904/1, 2020, Page(s) 11, ISSN 1538-4357
Publisher: IOP Publishing
DOI: 10.3847/1538-4357/abb953

The GRETOBAPE Gas-phase Reaction Network: The Importance of Being Exothermic

Author(s): Lorenzo Tinacci; Simón Ferrada-Chamorro; Cecilia Ceccarelli; Stefano Pantaleone; Daniela Ascenzi; Andrea Maranzana; Nadia Balucani; Piero Ugliengo
Published in: The Astrophysical Journal - Supplement Series, Issue Volume 266, Number 2, 2023, ISSN 0067-0049
Publisher: University of Chicago Press
DOI: 10.3847/1538-4365/accae9

a review on the controlling parameters and their implications from snowlines to chemical complexity

Author(s): Marco Minissale; Yuri Aikawa; Edwin Bergin; Mathieu Bertin; Wendy A. Brown; Stephanie Cazaux; Steven B. Charnley; Audrey Coutens; Herma M. Cuppen; Victoria Guzman; Harold Linnartz; Martin R. S. McCoustra; Albert Rimola; Johanna G.M. Schrauwen; Celine Toubin; Piero Ugliengo; Naoki Watanabe; Valentine Wakelam; Francois Dulieu
Published in: ACS Earth and Space Chemistry, Issue February 16th,2022, 2022, Page(s) 597-630, ISSN 2472-3452
Publisher: ACS Publications
DOI: 10.1021/acsearthspacechem.1c00357

ALMA chemical survey of disk-outflow sources in Taurus (ALMA-DOT). IV. Thioformaldehyde (H2CS) in protoplanetary disks: spatial distributions and binding energies

Author(s): C. Codella, L. Podio, A. Garufi, J. Perrero, P. Ugliengo, D. Fedele, C. Favre, E. Bianchi, C. Ceccarelli, S. Mercimek, F. Bacciotti, K.L.J. Rygl, L. Testi
Published in: Astronomy & Astrophysics, Issue December 2020, volume 644, 2020, ISSN 1432-0746
Publisher: EDP Science

Computational Surface Modelling of Ices and Minerals of Interstellar Interest—Insights and Perspectives

Author(s): Rimola, Albert; Ferrero, Stefano; Germain, Aurèle; Corno, Marta; Ugliengo, Piero
Published in: Minerals, Vol 11, Iss 26, p 26 (2021), Issue 2, 2020, ISSN 2075-163X
Publisher: MDPI
DOI: 10.3390/min11010026

SOLIS XII. SVS13-A Class I chemical complexity as revealed by S-bearing species

Author(s): C. Codella, E. Bianchi, L. Podio, S. Mercimek, C. Ceccarelli, A. Lopez-Sepulcre, R. Bachiller, P. Caselli, N. Sakai, R. Neri, F. Fontani, C. Favre, N. Balucani, B. Lefloch, S. Viti, S. Yamamoto
Published in: Astronomy & Astrophysics, Issue Volume 654, October 2021 (A52), 2021, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.1051/0004-6361/202141485

FAUST. II. Discovery of a Secondary Outflow in IRAS 15398−3359: Variability in Outflow Direction during the Earliest Stage of Star Formation?

Author(s): Yuki Okoda, Yoko Oya, Logan Francis, Doug Johnstone, Shu-ichiro Inutsuka, Cecilia Ceccarelli, Claudio Codella, Claire Chandler, Nami Sakai, Yuri Aikawa, Felipe O. Alves, Nadia Balucani, Eleonora Bianchi, Mathilde Bouvier, Paola Caselli, Emmanuel Caux, Steven Charnley, Spandan Choudhury, Marta De Simone, Francois Dulieu, Aurora Durán, Lucy Evans, Cécile Favre, Davide Fedele, Siyi Feng, Francesco
Published in: The Astrophysical Journal, Issue 910/1, 2021, Page(s) 11, ISSN 0004-637X
Publisher: University of Chicago Press
DOI: 10.3847/1538-4357/abddb1

SOLIS-XIII. Nitrogen fractionation towards the protocluster OMC-2 FIR4

Author(s): L. Evans, F. Fontani, C. Vastel, C. Ceccarelli, P. Caselli, A. López-Sepulcre, R. Neri, F. Alves, L. Chahine, C. Favre, V. Lattanzi
Published in: Astronomy & Astrophysics, Issue Volume 657, Issue 0, 2023, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.1051/0004-6361/202142147

Infrared action spectroscopy as tool for probing gas-phase dynamics: protonated dimethyl ether, (CH3)2OH+, formed by the reaction of CH3OH2+ with CH3OH

Author(s): V. Richardson; D. B. Rap; S. Brünken; D. Ascenzi
Published in: Molecular Physics : An International Journal at the Interface Between Chemistry and Physics, Issue Article: e2223079, 2023, ISSN 0026-8976
Publisher: Taylor & Francis
DOI: 10.1080/00268976.2023.2223079

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

Author(s): Pengxiao Liang; Emília Valença Ferreira de Aragão; Lisa Giani; Luca Mancini; Giacomo Pannacci; Demian Marchione; Gianmarco Vanuzzo; Noelia Faginas-Lago; Marzio Rosi; Dimitrios Skouteris; Piergiorgio Casavecchia; Nadia Balucani
Published in: The Journal of Physical Chemistry, Issue Volume 127 Issue 21, 2023, Page(s) 4609-4623, ISSN 1089-5639
Publisher: American Chemical Society
DOI: 10.1021/acs.jpca.2c08662

Reactions O(3P, 1D) + HCCCN(X1Σ+) (Cyanoacetylene): Crossed-Beam and Theoretical Studies and Implications for the Chemistry of Extraterrestrial Environments

Author(s): Pengxiao Liang; Emilia V. F. de Aragão; Giacomo Pannacci; Gianmarco Vanuzzo; Andrea Giustini; Demian Marchione; Pedro Recio; Francesco Ferlin; Domenico Stranges; Noelia Faginas Lago; Marzio Rosi; Piergiorgio Casavecchia; Nadia Balucani
Published in: The Journal of Physical Chemistry, Issue Jnauary 13, 2023, 2023, Page(s) 685-703, ISSN 1089-5639
Publisher: American Chemical Society
DOI: 10.1021/acs.jpca.2c07708

Enlightening the chemistry of infalling envelopes and accretion disks around Sun-like protostars: the ALMA FAUST project

Author(s): Codella, C.; Ceccarelli, C.; Sakai, C. Chandler N.; Yamamoto, S.; team, the FAUST
Published in: Frontiers Astronomy and Space Sciences, Issue Front. Astron. Space Sci., 23 December 2021 Sec. Astrochemistry Volume 8 - 2021, 2021, ISSN 2296-987X
Publisher: Frontiers Media SA
DOI: 10.3389/fspas.2021.782006

The Impact of Surface Passivation on Kapitza Resistance at the Interface between a Semiconductor and Liquid Nitrogen

Author(s): Babak Mohammadian, Mark A. McCulloch, Thomas Sweetnam, Valerio Gilles, Lucio Piccirillo
Published in: Journal of Low-Temperature, 2023, ISSN 0022-2291
Publisher: Kluwer Academic/Plenum Publishers
DOI: 10.48550/arxiv.2309.11192

Hunting for hot corinos and WCCC sources in the OMC-2/3 filament

Author(s): M. Bouvier, A. López-Sepulcre, C. Ceccarelli, C. Kahane, M. Imai, N. Sakai, S. Yamamoto, P. J. Dagdigian
Published in: Astronomy & Astrophysics, Issue 636, 2020, Page(s) A19, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.1051/0004-6361/201937164

Revealing the Physical Conditions around Sgr A* Using Bayesian Inference. I. Observations and Radiative Transfer

Author(s): Tomas A. James; Serena Viti; Serena Viti; Farhad Yusef-Zadeh; M. Royster; Mark Wardle
Published in: The Astrophysical Journal, Issue Volume 916, Number 2, 2021, ISSN 2041-8205
Publisher: Institute of Physics Publishing
DOI: 10.3847/1538-4357/abfd99

Chemical survey of Class I protostars with the IRAM-30 m

Author(s): S. Mercimek; C. Codella; L. Podio; E. Bianchi; L. Chahine; M. Bouvier; A. López-Sepulcre; R. Neri; C. Ceccarelli
Published in: Astronomy & Astrophysics, Issue Volume 659, March 2022 (Article A67), 2022, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.1051/0004-6361/202141790

The HH 212 Interstellar Laboratory: Astrochemistry as a Tool To Reveal Protostellar Disks on Solar System Scales around a Rising Sun

Author(s): Claudio Codella, Cecilia Ceccarelli, Chin-Fei Lee, Eleonora Bianchi, Nadia Balucani, Linda Podio, Sylvie Cabrit, Frederic Gueth, Antoine Gusdorf, Bertrand Lefloch, Benoit Tabone
Published in: ACS Earth and Space Chemistry, Issue 3/10, 2019, Page(s) 2110-2121, ISSN 2472-3452
Publisher: ACS Publications
DOI: 10.1021/acsearthspacechem.9b00136

Seeds of Life in Space (SOLIS). VI. Chemical evolution of sulfuretted species along the outflows driven by the low-mass protostellar binary

Author(s): S. Spezzano, C. Codella, L. Podio, C. Ceccarelli, P. Caselli, R. Neri, A. López-Sepulcre
Published in: Astronomy & Astrophysics, Issue A74, 2020, ISSN 0004-6361
Publisher: Springer Verlag

Seeds of Life in Space (SOLIS). XIII. Nitrogen fractionation towards the protocluster OMC-2 FIR4

Author(s): Evans, Lucy; Fontani, Francesco; Vastel, Charlotte; Ceccarelli, Cecilia; Caselli, Paola; L��pez-Sepulcre, Ana; Neri, Roberto; Alves, Felipe; Chahine, Layal; Favre, Cecile; Lattanzi, Valerio
Published in: Astronomy & Astrophysics, Issue Volume 671, March 2023, 2023, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.1051/0004-6361/202142147e

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

Author(s): D. Sundelin, D. Ascenzi, V. Richardson, C. Alcaraz, M. Polášek, C. Romanzin, R. Thissen, P. Tosi, J. Žabka, W. Geppert
Published in: Chemical Physics Letters, Issue 777, 2021, Page(s) 138677, ISSN 0009-2614
Publisher: Elsevier BV
DOI: 10.1016/j.cplett.2021.138677

FAUST – VIII. The protostellar disc of VLA 1623–2417W and its streamers imaged by ALMA

Author(s): S. Mercimek, L. Podio, C. Codella, L. Chahine, A. López-Sepulcre, S. Ohashi, L. Loinard, D. Johnstone, F. Menard, N. Cuello, P. Caselli, J. Zamponi, Y. Aikawa, E. Bianchi, G. Busquet, J. E. Pineda, M. Bouvier, M. De Simone, Y. Zhang, N. Sakai, C. J. Chandler, C. Ceccarelli, F. Alves, A. Durán, D. Fedele, N. Murillo, I. Jiménez-Serra, S. Yamamoto
Published in: Monthly notices of the Royal Astronomical Society, Issue Volume 522, Issue 2, June 2023, 2023, Page(s) 2384-2392, ISSN 0035-8711
Publisher: Blackwell Publishing Inc.
DOI: 10.1093/mnras/stad964

Modest Dust Settling in the IRAS04302+2247 Class I Protoplanetary Disk

Author(s): M. Villenave; L. Podio; G. Duchêne; K. R. Stapelfeldt; C. Melis; C. Carrasco-Gonzalez; V. J. M. Le Gouellec; F. Ménard; M. de Simone; C. Chandler; A. Garufi; C. Pinte; E. Bianchi; C. Codella
Published in: The Astrophysical Journal, Issue Volume 946, Number 2, 2023, ISSN 1538-4357
Publisher: IOP Science
DOI: 10.3847/1538-4357/acb92e

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

Author(s): Gianmarco Vanuzzo; Luca Mancini; Giacomo Pannacci; Pengxiao Liang; Demian Marchione; Pedro Recio; Yuxin Tan; Marzio Rosi; Dimitrios Skouteris; Piergiorgio Casavecchia; Nadia Balucani; Kevin M. Hickson; Jean-Christophe Loison; Michel Dobrijevic
Published in: ACS Earth and Space Chemistry, Issue 2022, 6, 10, 2022, Page(s) 2305-2321, ISSN 2472-3452
Publisher: ACS
DOI: 10.1021/acsearthspacechem.2c00183

Cyanopolyyne Chemistry in the L1544 Prestellar Core: New Insights from GBT Observations

Author(s): Eleonora Bianchi; Anthony Remijan; Claudio Codella; Cecilia Ceccarelli; Francois Lique; Silvia Spezzano; Nadia Balucani; Paola Caselli; Eric Herbst; Linda Podio; Charlotte Vastel; Brett McGuire
Published in: The Astrophysical Journal, Issue Volume 944, Number 2, 2023, ISSN 0004-637X
Publisher: University of Chicago Press
DOI: 10.3847/1538-4357/acb5e8

Reactivity of HCO with CH 3 and NH 2 on Water Ice Surfaces. A Comprehensive Accurate Quantum Chemistry Study

Author(s): Joan Enrique-Romero, Albert Rimola, Cecilia Ceccarelli, Piero Ugliengo, Nadia Balucani, Dimitrios Skouteris
Published in: ACS Earth and Space Chemistry, Issue 3/10, 2019, Page(s) 2158-2170, ISSN 2472-3452
Publisher: ACS Publications
DOI: 10.1021/acsearthspacechem.9b00156

Interstellar Formamide (NH 2 CHO), a Key Prebiotic Precursor

Author(s): Ana López-Sepulcre, Nadia Balucani, Cecilia Ceccarelli, Claudio Codella, François Dulieu, Patrice Theulé
Published in: ACS Earth and Space Chemistry, Issue 3/10, 2019, Page(s) 2122-2137, ISSN 2472-3452
Publisher: American Chemical Society
DOI: 10.1021/acsearthspacechem.9b00154

C2O and C3O in low-mass star-forming regions

Author(s): R. G. Urso, M. E. Palumbo, C. Ceccarelli, N. Balucani, S. Bottinelli, C. Codella, F. Fontani, P. Leto, C. Trigilio, C. Vastel, R. Bachiller, G. A. Baratta, C. S. Buemi, E. Caux, A. Jaber Al-Edhari, B. Lefloch, A. López-Sepulcre, G. Umana and L. Testi
Published in: Astronomy & Astrophysics, Issue 628, A72, 2019, ISSN 0004-6361
Publisher: Springer Verlag

Modeling the early mass ejection in jet-driven protostellar outflows: Lessons from Cep E

Author(s): P.R. Rivera-Ortiz; A. de A. Schutzer; B. Lefloch; A. Gusdorf
Published in: Astronomy & Astrophysics, Issue Volume 672, April 2023, 2023, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.1051/0004-6361/202245085

From gaseous HCN to nucleobases at the cosmic silicate dust surface: an experimental insight into the onset of prebiotic chemistry in space

Author(s): Rosangela Santalucia; Marco Pazzi; Francesca Bonino; Matteo Signorile; Domenica Scarano; Piero Ugliengo; Giuseppe Spoto; Lorenzo Mino
Published in: Physical Chemistry Chemical Physics, Issue 01/03/2022, Issue 12, 2022, Page(s) 7224-7230, ISSN 1463-9076
Publisher: Royal Society of Chemistry
DOI: 10.1039/d1cp05407d

Identifying the most constraining ice observations to infer molecular binding energies

Author(s): Johannes Heyl; Elena Sellentin; Jonathan Holdship; Serena Viti
Published in: Monthly Notices of the Royal Astronomical Society, Issue Volume 517, Issue 1, 2022, Page(s) 38-46, ISSN 0035-8711
Publisher: Blackwell Publishing Inc.
DOI: 10.1093/mnras/stac2652

Does Processing or Formation of Water Ice Mantles Affect the Capacity of Nanosilicates to Be the Source of Anomalous Microwave Emission?

Author(s): Joan Mariñoso Guiu, Stefano Ferrero, Antonio Macià Escatllar, Albert Rimola, Stefan T. Bromley
Published in: Frontiers in Astronomy and Space Sciences, Issue 8, 2021, ISSN 2296-987X
Publisher: Front. Astron. Space Sci.
DOI: 10.3389/fspas.2021.676548

Interferometric observations of warm deuterated methanol in the inner regions of low-mass protostars

Author(s): V. Taquet, E. Bianchi, C. Codella, M. V. Persson, C. Ceccarelli, S. Cabrit, J. K. Jørgensen, C. Kahane, A. López-Sepulcre, R. Neri
Published in: Astronomy & Astrophysics, Issue 632, 2019, Page(s) A19, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.1051/0004-6361/201936044

FAUST VI. VLA1623−2417 B: a new laboratory for astrochemistry around protostars on 50 au scale

Author(s): C. Codella, A. López-Sepulcre, S. Ohashi, C. J. Chandler, M. De Simone, L. Podio, C. Ceccarelli, N. Sakai, F. Alves, A. Durán, D. Fedele, L. Loinard, S. Mercimek, N. Murillo, E. Bianchi, M. Bouvier, G. Busquet, P. Caselli, F. Dulieu, S. Feng, T. Hanawa, D. Johnstone, B. Lefloch, L. T. Maud, G. Moellenbrock, Y. Oya, B. Svoboda, S. Yamamoto
Published in: Monthly Notices of the Royal Astronomical Society, Issue Volume 515, Issue 1, September 2022, 2022, Page(s) 543–554, ISSN 0035-8711
Publisher: Blackwell Publishing Inc.
DOI: 10.1093/mnras/stac1802

Revised gas-phase formation network of methyl cyanide: the origin of methyl cyanide and methanol abundance correlation in hot corinos

Author(s): Lisa Giani; Cecilia Ceccarelli; Luca Mancini; Eleonora Bianchi; Fernando Pirani; Marzio Rosi; Nadia Balucani
Published in: Monthly Notices of the Royal Astronomical Society, Issue Volume 526 Issue 3 December 2023, 2023, Page(s) 4535–4556, ISSN 0035-8711
Publisher: Blackwell Publishing Inc.
DOI: 10.1093/mnras/stad2892

Exploiting Network Topology for Accelerated Bayesian Inference of Grain Surface Reaction Networks

Author(s): Johannes Heyl, Serena Viti, Jonathan Holdship, Stephen M. Feeney
Published in: The Astrophysical Journal, Issue 904/2, 2020, Page(s) 197, ISSN 1538-4357
Publisher: IOP Publishing
DOI: 10.3847/1538-4357/abbeed

The SVS13-A Class I chemical complexity as revealed by S-bearing species. SOLIS XIII

Author(s): Codella, C.; Bianchi, E.; Podio, L.; Mercimek, S.; Ceccarelli, C.; Lopez-Sepulcre, A.; Bachiller, R.; Caselli, P.; Sakai, N.; Neri, R.; Fontani, F.; Favre, C.; Balucani, N.; Lefloch, B.; Viti, S.; Yamamoto, S.
Published in: Astronomy & Astrophysics, Issue 654, A52 (2021), 2021, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.48550/arxiv.2109.01142

XV. CH3CN deuteration in the SVS13-A Class I hot corino

Author(s): E. Bianchi; C. Ceccarelli; C. Codella; A. López-Sepulcre; S. Yamamoto; N. Balucani; P. Caselli; L. Podio; R. Neri; R. Bachiller; C. Favre; F. Fontani; B. Lefloch; N. Sakai; D. Segura-Cox
Published in: Astronomy & Astrophysics, Issue Volume 662, June 2022, Article A103, 2022, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.1051/0004-6361/202141893

XI. First measurement of nitrogen fractionation in shocked clumps of the L1157 protostellar outflow

Author(s): Benedettini, M.; Viti, S.; Codella, C.; Ceccarelli, C.; Neri, R.; López-Sepulcre, A.; Bianchi, E.; Busquet, G.; Caselli, P.; Fontani, F.; Lefloch, B.; Podio, L.; Spezzano, S.; Vastel, C.
Published in: Astronomy & Astrophysics, Issue Volume 645, January 2021, Article A91, 2021, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.1051/0004-6361/202039609

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

Author(s): Richardson V.;Valenca Ferreira de Aragao E.;He X.;Pirani F.;Mancini L.;Faginas-Lago N.;Rosi M.;Martini L. M.;Ascenzi D.
Published in: Physical Chemistry, Chemical Physics, Issue Issue 37, September 2022, 2022, ISSN 1463-9084
Publisher: Royal Society of Chemistry
DOI: 10.1039/d2cp02458f

The Effects of Cosmic Rays on the Chemistry of Dense Cores

Author(s): Ross O’Donoghue; Serena Viti; Marco Padovani; Tomas James
Published in: The Astrophysical Journal, Issue Volume 934, Number 1, 2022, ISSN 2041-8205
Publisher: Institute of Physics Publishing
DOI: 10.3847/1538-4357/ac7963

Structures and Properties of Known and Postulated Interstellar Cations

Author(s): Lorenzo Tinacci, Stefano Pantaleone, Andrea Maranzana, Nadia Balucani, Cecilia Ceccarelli, Piero Ugliengo
Published in: The Astrophysical Journal Supplement Series, Issue 256/2, 2021, Page(s) 35, ISSN 0067-0049
Publisher: University of Chicago Press
DOI: 10.3847/1538-4365/ac194c

Ammonia snow lines and ammonium salts desorption

Author(s): F. Kruczkiewicz, J. Vitorino, E. Congiu, P. Theulé, F. Dulieu
Published in: Astronomy & Astrophysics, Issue April 16th, 2021, 2021, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.1051/0004-6361/202140579

Computer Generated Realistic Interstellar Icy Grain Models: Physicochemical Properties and Interaction with NH3

Author(s): Aurèle Germain; Lorenzo Tinacci; Stefano Pantaleone; Cecilia Ceccarelli; Piero Ugliengo
Published in: ACS Earth and Space Chemistry, Issue 2022, 6, 5, 2022, Page(s) 1286–1298, ISSN 2472-3452
Publisher: ACS publications
DOI: 10.1021/acsearthspacechem.2c00004

Organic chemistry in the protosolar analogue HOPS-108: Environment matters

Author(s): L. Chahine; Ana López-Sepulcre; R. Neri; Cecilia Ceccarelli; S. Mercimek; C. Codella; Mathilde Bouvier; E. Bianchi; Cécile Favre; Linda Podio; Felipe O. Alves; Nami Sakai; Satoshi Yamamoto
Published in: Astronomy & Astrophysics, Issue Volume 657, January 2022, 2022, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.1051/0004-6361/202141811

H 2 Formation on Interstellar Grains and the Fate of Reaction Energy

Author(s): Stefano Pantaleone; Joan Enrique-Romero; Cecilia Ceccarelli; Stefano Ferrero; Nadia Balucani; Albert Rimola; Piero Ugliengo
Published in: The Astrophysical journal, Issue 2021 August 16, 2021, ISSN 1742-6596
Publisher: IOP Publishing
DOI: 10.3847/1538-4357/ac0142

H2O˙+ and OH+ reactivity versus furan: experimental low energy absolute cross sections for modeling radiation damage

Author(s): Daniela Ascenzi; Ewa Erdmann; Paola Bolognesi; Lorenzo Avaldi; Mattea Carmen Castrovilli; Roland Thissen; Claire Romanzin; Christian Alcaraz; Ismanuel Rabadan; Luis Mendez; Sergio Díaz-Tendero; Antonella Cartoni
Published in: Physical Chemistry, Chemical Physics, Issue issue 36, 2023, 2023, ISSN 1463-9076
Publisher: Royal Society of Chemistry
DOI: 10.1039/d3cp02772d

A Detailed Temperature Map of the Archetypal Protostellar Shocks in L1157

Author(s): S. Feng; H. B. Liu; P. Caselli; A. Burkhardt; F. Du; R. Bachiller; C. Codella; C. Ceccarelli
Published in: The Astrophysical Journal Letters, Issue Volume 933, Number 2, L35, 2022, ISSN 2041-8205
Publisher: Institute of Physics Publishing
DOI: 10.3847/2041-8213/ac75d7

an MCMC inference tool for physical parameters of molecular clouds

Author(s): Marcus Keil; Serena Viti; Jonathan Holdship
Published in: The Astrophysical Journal, 927:203, Issue Volume 927, Number 2, 2022, ISSN 2041-8205
Publisher: Institute of Physics Publishing
DOI: 10.3847/1538-4357/ac51d0

Experimental and Computational Studies on the Reactivity of Methanimine Radical Cation (H2CNH+•) and its Isomer Aminomethylene (HCNH2+•) With C2H2

Author(s): Vincent Richardson, Daniela Ascenzi, David Sundelin, Christian Alcaraz, Claire Romanzin, Roland Thissen, Jean-Claude Guillemin, Miroslav Polášek, Paolo Tosi, Jan Žabka and Wolf D. Geppert
Published in: Frontiers in Astronomy and Space Sciences, Issue October 21, 2021, 2021, ISSN 2296-987X
Publisher: Frontiers Astron. Space Sci.
DOI: 10.3389/fspas.2021.752376

Streamers feeding the SVS13-A protobinary system: astrochemistry reveals accretion shocks?

Author(s): Eleonora Bianchi; Ana López-Sepulcre; Cecilia Ceccarelli; Claudio Codella; Linda Podio; Mathilde Bouvier; Joan Enrique-Romero; Rafael Bachiller; Bertrand Lefloch
Published in: Faraday Discussions, Issue Volume 245, 2023, 2023, ISSN 1359-6640
Publisher: Royal Society of Chemistry
DOI: 10.1039/d3fd00018d

CH$_3$CN deuteration in the SVS13-A Class I hot-corino. SOLIS XV

Author(s): Bianchi, Eleonora; Ceccarelli, Cecilia; Codella, Claudio; López-Sepulcre, Ana; Yamamoto, Satoshi; Balucani, Nadia; Caselli, Paola; Podio, Linda; Neri, Roberto; Bachiller, Rafael; Favre, Cécile; Fontani, Francesco; Lefloch, Bertrand; Sakai, Nami; Segura-Cox, Dominique
Published in: Astronomy & Astrophysics, Issue Volume662, June 2022, 2022, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.48550/arxiv.2202.09285

Stratified Distribution of Organic Molecules at the Planet-formation Scale in the HH 212 Disk Atmosphere

Author(s): Chin-Fei Lee; Claudio Codella; Cecilia Ceccarelli; Ana López-Sepulcre
Published in: The Astrophysical Journal, Issue 16 September 2022, 2022, Page(s) 937, ISSN 1538-4357
Publisher: IOP Publishing
DOI: 10.3847/1538-4357/ac8c28

OMC-2 FIR 4 under the microscope: Shocks, filaments, and a highly collimated jet at 100 au scales

Author(s): L. Chahine; A. López-Sepulcre; L. Podio; C. Codella; R. Neri; S. Mercimek; M. De Simone; P. Caselli; C. Ceccarelli; M. Bouvier; N. Sakai; F. Fontani; S. Yamamoto; F. O. Alves; V. Lattanzi; L. Evans; C. Favre
Published in: Astronomy & Astrophysics, Issue A&A 667, A6 (2022), 2022, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.1051/0004-6361/202243799

ALMA chemical survey of disk-outflow sources in Taurus (ALMA-DOT)

Author(s): A. Garufi, L. Podio, C. Codella, K. Rygl, F. Bacciotti, S. Facchini, D. Fedele, A. Miotello, R. Teague, L. Testi
Published in: Astronomy & Astrophysics, Issue 636, 2020, Page(s) A65, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.1051/0004-6361/201937247

We Drink Good 4.5-Billion-Year-Old Water

Author(s): Cecilia Ceccarelli; Fujun Du
Published in: Elements, Issue Volume 18, Number 3, 2022, Page(s) 155-160, ISSN 1811-5209
Publisher: Mineralogical Society of America
DOI: 10.2138/gselements.18.3.155

First measurement of nitrogen fractionation in shocked clumps of the L1157 protostellar outflow. SOLIS XI

Author(s): Benedettini, M.; Viti, S.; Codella, C.; Ceccarelli, C.; Bianchi, E.; Busquet, G.; Caselli, P.; Fontani, F.; Lefloch, B.; Podio, L.; Spezzano, S.; Vastel, C.
Published in: Astronomy and Astrophysics, Issue January 2021, 2021, Page(s) A91, ISSN 0004-6361
Publisher: Springer Verlag

The Two Hot Corinos of the SVS13-A Protostellar Binary System: Counterposed Siblings

Author(s): Eleonora Bianchi; Ana López-Sepulcre; Cecilia Ceccarelli; Claudio Codella; Linda Podio; Mathilde Bouvier; Joan Enrique-Romero
Published in: The astrophysical Journal Letters, Issue Volume 928, number 1, 2022, ISSN 2041-8205
Publisher: Institute of Physics Publishing
DOI: 10.3847/2041-8213/ac5a56

FAUST III. Misaligned rotations of the envelope, outflow, and disks in the multiple protostellar system of VLA 1623$-$2417

Author(s): Ohashi, Satoshi; Codella, Claudio; Sakai, Nami; Chandler, Claire J.; Ceccarelli, Cecilia; Alves, Felipe; Fedele, Davide; Hanawa, Tomoyuki; Dur��n, Aurora; Favre, C��cile; L��pez-Sepulcre, Ana; Loinard, Laurent; Mercimek, Seyma; Murillo, Nadia M.; Podio, Linda; Zhang, Yichen; Aikawa, Yuri; Balucani, Nadia; Bianchi, Eleonora; Bouvier, Mathilde; Busquet, Gemma; Caselli, Paola; Caux, Emman
Published in: The Astrophysical Journal, Issue ApJ 927 54, 2022, ISSN 2041-8205
Publisher: Institute of Physics Publishing
DOI: 10.3847/1538-4357/ac4cae

Parametric Amplification via Superconducting Contacts in a Ka Band Niobium Pillbox Cavity

Author(s): V. Gilles; D. Banys; M. A. McCulloch; L. Piccirillo; T. Sweetnam
Published in: Journal of low temperature Physics, Issue 211, 2023, Page(s) 302-309, ISSN 0022-2291
Publisher: Kluwer Academic/Plenum Publishers
DOI: 10.1007/s10909-022-02891-w

FAUST I. The hot corino at the heart of the prototypical Class I protostar L1551 IRS5

Author(s): E Bianchi, C J Chandler, C Ceccarelli, C Codella, N Sakai, A López-Sepulcre, L T Maud, G Moellenbrock, B Svoboda, Y Watanabe, T Sakai, F Ménard, Y Aikawa, F Alves, N Balucani, M Bouvier, P Caselli, E Caux, S Charnley, S Choudhury, M De Simone, F Dulieu, A Durán, L Evans, C Favre, D Fedele, S Feng, F Fontani, L Francis, T Hama, T Hanawa, E Herbst, T Hirota, M Imai, A Isella, I Jiménez-Serra, D
Published in: Monthly Notices of the Royal Astronomical Society: Letters, Issue 498/1, 2020, Page(s) L87-L92, ISSN 1745-3933
Publisher: Blackwell Publishing
DOI: 10.1093/mnrasl/slaa130

A train of shocks at 3000-au scale? Exploring the clash of an expanding bubble into the NGC 1333 IRAS 4 region. SOLIS XIV

Author(s): Marta De Simone; Claudio Codella; Cecilia Ceccarelli; Ana López-Sepulcre; Roberto Neri; Pedro Ruben Rivera-Ortiz; Gemma Busquet; Paola Caselli; Eleonora Bianchi; Francesco Fontani; Bertrand Lefloch; Yoko Oya; Jaime E Pineda
Published in: Monthly Notices of the Royal Astronomical Society, Issue Volume 512 Issue 4 (June 2022), 2022, ISSN 0035-8711
Publisher: Blackwell Publishing Inc.
DOI: 10.1093/mnras/stac083

Understanding molecular abundances in star-forming regions using interpretable machine learning

Author(s): Johannes Heyl; Joshua Butterworth; Serena Viti
Published in: Monthly Notices of the Royal Astronomical Society, Issue Volume 526, Issue 1, November 2023, 2023, Page(s) 404-422, ISSN 0035-8711
Publisher: Blackwell Publishing Inc.
DOI: 10.1093/mnras/stad2814

ALMA chemical survey of disk-outflow sources in Taurus (ALMA-DOT)VI. Accretion shocks in the disk of DG Tau and HL Tau

Author(s): A. Garufi, L. Podio, C. Codella, D. Segura-Cox, M. Vander Donckt, S. Mercimek, F. Bacciotti, D. Fedele, M. Kasper, J. E. Pineda, E. Humphreys, L. Testi
Published in: Astronomy & Astrophysics, Issue Volume 658, February 2022 (A104), 2022, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.1051/0004-6361/202141264

Mass ejection and time variability in protostellar outflows: Cep E. SOLIS XVI

Author(s): Schutzer, A. de A.; Rivera-Ortiz, P. R.; Lefloch, B.; Gusdorf, A.; Favre, C.; Segura-Cox, D.; Lopez-Sepulcre, A.; Neri, R.; Ospina-Zamudio, J.; De Simone, M.; Codella, C.; Viti, S.; Podio, L.; Pineda, J.; O'Donoghue, R.; Ceccarelli, C.; Caselli, P.; Alves, F.; Bachiller, R.; Balucani, N.; Bianchi, E.; Bizzocchi, L.; Bottinelli, S.; Caux, E.; Chacón-Tanarro, A.; Dulieu, F.; Enrique-Romero, J.; Fon
Published in: Astronomy & Astrophysics, Issue Volume 662, June 2022, article A104, 2022, ISSN 0004-6361
Publisher: Springer Verlag
DOI: 10.48550/arxiv.2203.09383

Interaction of HCO+ Cations With Interstellar Negative Grains. Quantum Chemical Investigation and Astrophysical Implications

Author(s): Albert Rimola, Cecilia Ceccarelli, Nadia Balucani, Piero Ugliengo
Published in: Frontiers in Astronomy and Space Sciences, Issue 8, 2021, ISSN 2296-987X
Publisher: Front. Astron. Space Sci.
DOI: 10.3389/fspas.2021.655405

Tracing the Primordial Chemical Life of Glycine: A Review from Quantum Chemical Simulations

Author(s): Piero Ugliengo; Albert Rimola; Nadia Balucani; Cecilia Ceccarelli
Published in: International Journal of Molecular Science, Issue 23(8), 4252, 2022, ISSN 1422-0067
Publisher: Multidisciplinary Digital Publishing Institute (MDPI)
DOI: 10.3390/ijms23084252

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

Author(s): V. Richardson, C. Alcaraz, W.D. Geppert, M. Polášek, C. Romanzin, D. Sundelin, R. Thissen, P. Tosi, J. Žabka, D. Ascenzi
Published in: Chemical Physics Letters, Issue 775, 2021, Page(s) 138611, ISSN 0009-2614
Publisher: Elsevier BV
DOI: 10.1016/j.cplett.2021.138611

Coding Cross Sections of an Electron Charge Transfer Process

Author(s): Emília Valença Ferreira de Aragão; Luca Mancini; Xiao He; Noelia Faginas-Lago; Marzio Rosi; Daniela Ascenzi; Fernando Pirani
Published in: Computational Science and Its Applications – ICCSA 2022 Workshops ISBN: 9783031105913, Issue Lecture Notes in Computer Science book series (LNCS,volume 13382), 2022, ISBN 9783031105913
Publisher: Springer Link
DOI: 10.1007/978-3-031-10592-0_24

Coding Cross Sections of an Electron Charge Transfer Process

Author(s): de Aragão, Emília Valença Ferreira; Mancini, Luca; He, Xiao; Faginas-Lago, Noelia; Rosi, Marzio; Ascenzi, Daniela; Pirani, Fernando
Published in: ICCSA 2022: Computational Science and Its Applications – ICCSA 2022 Workshops, Issue Lecture Notes in Computer Science book series (LNCS,volume 13382), 2022
Publisher: SpringerLink
DOI: 10.48550/arxiv.2212.11903

The S$^+$($^4$S) + SiH$_{2}$($^1$A$_1$) Reaction: Toward the Synthesis of Interstellar SiS

Author(s): Mancini, Luca; Trinari, Marco; de Aragão, Emília Valença Ferreira; Rosi, Marzio; Balucani, Nadia
Published in: ICCSA 2022, Issue 04/08/2022, 2022, Page(s) 233-245
Publisher: Springer Link
DOI: 10.1007/978-3-031-10562-3_17

Long-Range Complex in the HC3N + CN Potential Energy Surface: Ab Initio Calculations and Intermolecular Potential

Author(s): de Aragão, Emília Valença Ferreira; Mancini, Luca; Faginas-Lago, Noelia; Rosi, Marzio; Balucani, Nadia; Pirani, Fernando
Published in: ICCSA 2021 Computational Science and Its Applications 2021, 2021, Page(s) 413-425
Publisher: Springer
DOI: 10.1007/978-3-030-87016-4_31

A Computational Study of the Reaction Cyanoacetylene and Cyano Radical leading to 2-Butynedinitrile and Hydrogen Radical

Author(s): Valença Ferreira de Aragão, Emília; Faginas-Lago, Noelia; Rosi, Marzio; Mancini, Luca; Balucani, Nadia; Skouteris, Dimitrios
Published in: Computational Science and Its Applications – ICCSA 2020, Issue Lecture Notes in Computer Science book series (LNTCS,volume 12251), 2020, Page(s) 707-716
Publisher: Springer Link
DOI: 10.48550/arxiv.2107.06003

Ab initio Calculation of Binding Energies of Interstellar Sulphur-Containing Species on Crystalline Water Ice Models

Author(s): Perrero, Jessica; Rimola, Albert; Corno, Marta; Ugliengo, Piero
Published in: ICCSA 2021: Computational Science and Its Applications – ICCSA 2021, Issue Lecture Notes in Computer Science book series (LNTCS,volume 12953), 2021, Page(s) 608-619
Publisher: Springer Link
DOI: 10.48550/arxiv.2110.06010

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

Author(s): de Aragão, Emília Valença Ferreira; Faginas-Lago, Noelia; Apriliyanto, Yusuf Bramastya; Lombardi, Andrea
Published in: Computational Science and Its Applications – ICCSA 2020, Issue LNTC volume 12255, 2020, Page(s) 513-525
Publisher: Springer
DOI: 10.48550/arxiv.2107.08904

Building chemical complexity with ion-molecule reactions: from protostellar stages to Solar System planets and exoplanets

Author(s): Vincent Richardson; Christian Alcaraz; Wolf Geppert; Jean-Claude Guillemin; Miroslav Polášek; Claire Romanzin; David Sundelin; Roland Thissen; Paolo Tosi; Daniela Ascenzi
Published in: Crossref, Issue 1, 2020
Publisher: Europlanet Science Congress
DOI: 10.5194/epsc2020-736

Organic chemistry in the first phases of Solar-type protostars

Author(s): Ceccarelli, C.; Codella, C.; Balucani, N.; Bockelée-Morvan, D.; Herbst, E.; Vastel, C.; Caselli, P.; Favre, C.; Lefloch, B.; Öberg, K.
Published in: Issue 10-15 April 2023, 2022
Publisher: PPVII
DOI: 10.48550/arxiv.2206.13270

Formamide Dehydration and Condensation on Acidic Montmorillonite: Mechanistic Insights from Ab-Initio Periodic Simulations

Author(s): Stefano Pantaleone; Stefano Pantaleone; Albert Rimola; Javier Navarro-Ruiz; Pierre Mignon; Mariona Sodupe; Piero Ugliengo; Nadia Balucani; Nadia Balucani
Published in: Computational Science and Its Applications – ICCSA 2020 ISBN: 9783030588199, Issue Lecture Notes in Computer Science book series (LNTCS,volume 12255), 2020, ISBN 9783030588199
Publisher: Springer Link
DOI: 10.1007/978-3-030-58820-5_37

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

Author(s): Aurèle Germain; Marta Corno; Piero Ugliengo
Published in: Computational Science and Its Applications – ICCSA 2021, Issue ICCSA2021, 2021, Page(s) 632-645, ISBN 9783030869755
Publisher: Springer link
DOI: 10.1007/978-3-030-86976-2_43

Ab initio Calculation of Binding Energies of Interstellar Sulphur-Containing Species on Crystalline Water Ice Models.

Author(s): Jessica Perrero; Albert Rimola; Marta Corno; Piero Ugliengo
Published in: ICCSA 2021: Computational Science and Its Applications – ICCSA 2021, Issue Lecture Notes in Computer Science book series (LNTCS,volume 12953), 2021, ISBN 978-3-030-86975-5
Publisher: SpringerLink
DOI: 10.1007/978-3-030-86976-2_41

A Computational Analysis of the Reaction of Atomic Oxygen O( 3 P) with Acrylonitrile.

Author(s): Luca Mancini; Emília Valença Ferreira de Aragão
Published in: Computational Science and Its Applications – ICCSA 2021 ISBN: 9783030870157, Issue Lecture Notes in Computer Science book series (LNTCS,volume 12958), 2021, ISBN 9783030870157
Publisher: Springer Link
DOI: 10.1007/978-3-030-87016-4_25

Modeling Interstellar Amorphous Solid Water Grains by Tight-Binding Based Methods: Comparison Between GFN-XTB and CCSD(T) Results for Water Clusters

Author(s): Aurèle Germain, Piero Ugliengo
Published in: Computational Science and Its Applications – ICCSA 2020 - 20th International Conference, Cagliari, Italy, July 1–4, 2020, Proceedings, Part V, Issue 12253, 2020, Page(s) 745-753, ISBN 978-3-030-58813-7
Publisher: Springer International Publishing
DOI: 10.1007/978-3-030-58814-4_62

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

Author(s): Emília Valença Ferreira de Aragão, Noelia Faginas-Lago, Yusuf Bramastya Apriliyanto, Andrea Lombardi
Published in: Computational Science and Its Applications – ICCSA 2020 - 20th International Conference, Cagliari, Italy, July 1–4, 2020, Proceedings, Part VII, Issue 12255, 2020, Page(s) 513-525, ISBN 978-3-030-58819-9
Publisher: Springer International Publishing
DOI: 10.1007/978-3-030-58820-5_38

A Computational Study of the Reaction Cyanoacetylene and Cyano Radical Leading to 2-Butynedinitrile and Hydrogen Radical

Author(s): Emília Valença Ferreira de Aragão, Noelia Faginas-Lago, Marzio Rosi, Luca Mancini, Nadia Balucani, Dimitrios Skouteris
Published in: Computational Science and Its Applications – ICCSA 2020 - 20th International Conference, Cagliari, Italy, July 1–4, 2020, Proceedings, Part III, Issue 12251, 2020, Page(s) 707-716, ISBN 978-3-030-58807-6
Publisher: Springer International Publishing
DOI: 10.1007/978-3-030-58808-3_51

Astrochemical reaction networks: bringing order to chaos

Author(s): Tinacci, Lorenzo
Published in: Issue 5, 2023
Publisher: Université Grenoble Alpes
DOI: 10.5281/zenodo.8032333

ALMA chemical survey of disk-outflow sources in Taurus (ALMA-DOT) II: Vertical stratification of CO, CS, CN, H2CO, and CH3OH in a Class I disk

Author(s): L. Podio, A. Garufi, C. Codella, D. Fedele, E. Bianchi, F. Bacciotti, C. Ceccarelli, C. Favre, S. Mercimek, K. Rygl, L. Testi
Published in: Astronomy & Astrophysics, Issue Letters to the editor, 2020, ISSN 1432-0746
Publisher: EDP Science
DOI: 10.1051/0004-6361/202038952

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