Possible Formation and Destruction of the OD+ Ions in the Interstellar Medium
| dc.contributor.author | Bulut, Niyazi | |
| dc.contributor.author | Roncero, Octavio | |
| dc.contributor.author | Lique, Francois | |
| dc.date.accessioned | 2026-08-12T17:35:33Z | |
| dc.date.issued | 2020 | |
| dc.department | Fırat Üniversitesi | |
| dc.description.abstract | The OH+ ion is an important constituent of the interstellar medium (ISM). It can be used as a probe of cosmic ray and X-ray ionization rates in molecular clouds as well as a tracer of oxygen chemistry. The deuterated variant of OH+, the OD+ ion, may also be present in the ISM despite the fact that it has not been detected yet. In this paper, we aim at providing quantitative insight into the OD+ chemistry and at accurately studying the possible formation and destruction processes of OD+ in the ISM. We study the formation and destruction of OD+ through the O+ + HD -> OD+ + H and OH+ + D <-> OD+ + H reactions that can occur in diffuse ISM. Reactive rate constants have been obtained from exact state-to-state quantum wave packet calculations for temperatures ranging from 10 to 1000 K. The new theoretical data are validated through a detailed comparison with available experimental data. The formation of OD+ is found to be less efficient than that of OH+. As a first application, the OD+/OH+ abundance ratio in ISM has been evaluated from a simple astrochemical model, and we found that this ratio can be larger than D/H abundance ratio only at low temperatures. These calculations may help in an astrochemical search of OD+ in cold ISM. | |
| dc.description.sponsorship | French-Spanish collaborative project PICS [PIC2017FR7]; European Research Council (Consolidator Grant COLLEXISM) [811363]; Institut Universitaire de France, and the Programme National Physique et Chimie du Milieu Interstellaire (PCMI) of CNRS/INSU; INC/INP; CEA; CNES; MICIU [FIS2017-83473-C2]; RES Computational Grants [ACCT-2019-3-0004, AECT-2020-1-0003]; GENCI-CINES [A0070411036]; European Research Council (ERC) [811363] Funding Source: European Research Council (ERC) | |
| dc.description.sponsorship | We acknowledge the French-Spanish collaborative project PICS (ref. PIC2017FR7). F.L. acknowledges financial support from the European Research Council (Consolidator Grant COLLEXISM, Grant Agreement 811363), the Institut Universitaire de France, and the Programme National Physique et Chimie du Milieu Interstellaire (PCMI) of CNRS/INSU with INC/INP cofunded by CEA and CNES. O.R. acknowledges the support from MICIU under Grant No. FIS2017-83473-C2 and for computing time at Finisterrae (CESGA) and Marenostrum (BSC) under RES Computational Grants ACCT-2019-3-0004 and AECT-2020-1-0003. N.B. acknowledges the computing facilities of TUBITAKTRUBA. This work was performed using HPC resources from GENCI-CINES (Grant A0070411036) | |
| dc.identifier.doi | 10.1021/acs.jpca.0c05021 | |
| dc.identifier.endpage | 6561 | |
| dc.identifier.issn | 1089-5639 | |
| dc.identifier.issn | 1520-5215 | |
| dc.identifier.issue | 32 | |
| dc.identifier.orcid | 0000-0002-0664-2536 | |
| dc.identifier.orcid | 0000-0003-2863-7700 | |
| dc.identifier.orcid | 0000-0002-8871-4846 | |
| dc.identifier.pmid | 32687711 | |
| dc.identifier.scopus | 2-s2.0-85089610093 | |
| dc.identifier.scopusquality | Q2 | |
| dc.identifier.startpage | 6552 | |
| dc.identifier.uri | https://doi.org/10.1021/acs.jpca.0c05021 | |
| dc.identifier.uri | https://hdl.handle.net/11508/57587 | |
| dc.identifier.volume | 124 | |
| dc.identifier.wos | WOS:000562942600018 | |
| dc.identifier.wosquality | Q2 | |
| dc.indekslendigikaynak | Web of Science | |
| dc.indekslendigikaynak | Scopus | |
| dc.indekslendigikaynak | PubMed | |
| dc.language.iso | en | |
| dc.publisher | Amer Chemical Soc | |
| dc.relation.ispartof | Journal of Physical Chemistry A | |
| dc.relation.publicationcategory | Makale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanı | |
| dc.rights | info:eu-repo/semantics/closedAccess | |
| dc.snmz | KA_WoS_20260511 | |
| dc.subject | Potential-Energy Surfaces | |
| dc.subject | Temperature-Dependence | |
| dc.subject | Branching Ratio | |
| dc.subject | Quantum | |
| dc.subject | Dynamics | |
| dc.subject | O+ | |
| dc.title | Possible Formation and Destruction of the OD+ Ions in the Interstellar Medium | |
| dc.type | Article |







