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D'Angelo, Giovanna
Publications (4 of 4) Show all publications
Giacomozzi, L., D'Angelo, G., Diaz-Tendero, S., de Ruette, N., Stockett, M. H., Alcami, M., . . . Zettergren, H. (2019). Decay pathways for protonated and deprotonated adenine molecules. Journal of Chemical Physics, 151(4), Article ID 044306.
Open this publication in new window or tab >>Decay pathways for protonated and deprotonated adenine molecules
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2019 (English)In: Journal of Chemical Physics, ISSN 0021-9606, E-ISSN 1089-7690, Vol. 151, no 4, article id 044306Article in journal (Refereed) Published
Abstract [en]

We have measured fragment mass spectra and total destruction cross sections for protonated and deprotonated adenine following collisions with He at center-of-mass energies in the 20-240 eV range. Classical and ab initio molecular dynamics simulations are used to provide detailed information on the fragmentation pathways and suggest a range of alternative routes compared to those reported in earlier studies. These new pathways involve, for instance, losses of HNC molecules from protonated adenine and losses of NH2 or C3H2N2 from deprotonated adenine. The present results may be important to advance the understanding of how biomolecules may be formed and processed in various astrophysical environments.

National Category
Chemical Sciences Physical Sciences
Identifiers
urn:nbn:se:su:diva-171998 (URN)10.1063/1.5109963 (DOI)000478625700041 ()31370544 (PubMedID)2-s2.0-85070076851 (Scopus ID)
Available from: 2019-08-30 Created: 2019-08-30 Last updated: 2022-11-02Bibliographically approved
Gatchell, M., Delaunay, R., D'Angelo, G., Mika, A., Kulyk, K., Domaracka, A., . . . Cederquist, H. (2017). Ion-induced molecular growth in clusters of small hydrocarbon chains. Physical Chemistry, Chemical Physics - PCCP, 19(30), 19665-19672
Open this publication in new window or tab >>Ion-induced molecular growth in clusters of small hydrocarbon chains
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2017 (English)In: Physical Chemistry, Chemical Physics - PCCP, ISSN 1463-9076, E-ISSN 1463-9084, Vol. 19, no 30, p. 19665-19672Article in journal (Refereed) Published
Abstract [en]

We report on studies of collisions between 3 keV Ar+ projectile ions and neutral targets of isolated 1,3-butadiene (C4H6) molecules and cold, loosely bound clusters of these molecules. We identify molecular growth processes within the molecular clusters that appears to be driven by knockout processes and that could result in the formation of (aromatic) ring structures. These types of reactions are not unique to specific projectile ions and target molecules, but will occur whenever atoms or ions with suitable masses and kinetic energies collide with aggregates of matter, such as carbonaceous grains in the interstellar medium or aerosol nanoparticles in the atmosphere.

National Category
Physical Sciences
Identifiers
urn:nbn:se:su:diva-147091 (URN)10.1039/c7cp02090b (DOI)000407053000015 ()28503696 (PubMedID)2-s2.0-85027382003 (Scopus ID)
Available from: 2017-10-12 Created: 2017-10-12 Last updated: 2022-10-20Bibliographically approved
Giacomozzi, L., Gatchell, M., de Ruette, N., Wolf, M., D'Angelo, G., Schmidt, H. T., . . . Zettergren, H. (2017). Knockout driven fragmentation of porphyrins. Physical Chemistry, Chemical Physics - PCCP, 19(30), 19750-19755
Open this publication in new window or tab >>Knockout driven fragmentation of porphyrins
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2017 (English)In: Physical Chemistry, Chemical Physics - PCCP, ISSN 1463-9076, E-ISSN 1463-9084, Vol. 19, no 30, p. 19750-19755Article in journal (Refereed) Published
Abstract [en]

We have studied collisions between tetraphenylporphyrin cations and He or Ne at center-of-mass energies in the range 50-110 eV. The experimental results were interpreted in view of density functional theory calculations of dissociation energies and classical molecular dynamics simulations of how the molecules respond to the He/Ne impact. We demonstrate that prompt atom knockout strongly contributes to the total destruction cross sections. Such impulse driven processes typically yield highly reactive fragments and are expected to be important for collisions with any molecular system in this collision energy range, but have earlier been very difficult to isolate for biomolecules.

National Category
Physical Sciences
Research subject
Physics
Identifiers
urn:nbn:se:su:diva-147092 (URN)10.1039/c7cp01583f (DOI)000407053000024 ()28627574 (PubMedID)2-s2.0-85027328953 (Scopus ID)
Available from: 2017-10-12 Created: 2017-10-12 Last updated: 2022-10-20Bibliographically approved
Giacomozzi, L., D'Angelo, G., Diaz-Tendero, S., de Ruette, N., Stockett, M., Alcamí, M., . . . Zettergren, H.Decay pathways for protonated and deprotonated Adenine molecules.
Open this publication in new window or tab >>Decay pathways for protonated and deprotonated Adenine molecules
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(English)Manuscript (preprint) (Other academic)
National Category
Atom and Molecular Physics and Optics
Research subject
Physics
Identifiers
urn:nbn:se:su:diva-166999 (URN)
Available from: 2019-03-12 Created: 2019-03-12 Last updated: 2022-02-26Bibliographically approved
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