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Low temperature rates for key steps of interstellar gas-phase water formation

The gas-phase formation of water molecules in the diffuse interstellar medium (ISM) proceeds mainly via a series of reactions involving the molecular ions OH(+), H(2)O(+), and H(3)O(+) and molecular hydrogen. These reactions form the backbone for the chemistry leading to the formation of several com...

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Autores principales: Kumar, Sunil S., Grussie, Florian, Suleimanov, Yury V., Guo, Hua, Kreckel, Holger
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Association for the Advancement of Science 2018
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6014714/
https://www.ncbi.nlm.nih.gov/pubmed/29942857
http://dx.doi.org/10.1126/sciadv.aar3417
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author Kumar, Sunil S.
Grussie, Florian
Suleimanov, Yury V.
Guo, Hua
Kreckel, Holger
author_facet Kumar, Sunil S.
Grussie, Florian
Suleimanov, Yury V.
Guo, Hua
Kreckel, Holger
author_sort Kumar, Sunil S.
collection PubMed
description The gas-phase formation of water molecules in the diffuse interstellar medium (ISM) proceeds mainly via a series of reactions involving the molecular ions OH(+), H(2)O(+), and H(3)O(+) and molecular hydrogen. These reactions form the backbone for the chemistry leading to the formation of several complex molecular species in space. A comprehensive understanding of the mechanisms involved in these reactions in the ISM necessitates an accurate knowledge of the rate coefficients at the relevant temperatures (10 to 100 K). We present measurements of the rate coefficients for two key reactions below 100 K, which, in both cases, are significantly higher than the values used in astronomical models thus far. The experimental rate coefficients show excellent agreement with dedicated theoretical calculations using a novel ring-polymer molecular dynamics approach that offers a first-principles treatment of low-temperature barrierless gas-phase reactions, which are prevalent in interstellar chemical networks.
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spelling pubmed-60147142018-06-25 Low temperature rates for key steps of interstellar gas-phase water formation Kumar, Sunil S. Grussie, Florian Suleimanov, Yury V. Guo, Hua Kreckel, Holger Sci Adv Research Articles The gas-phase formation of water molecules in the diffuse interstellar medium (ISM) proceeds mainly via a series of reactions involving the molecular ions OH(+), H(2)O(+), and H(3)O(+) and molecular hydrogen. These reactions form the backbone for the chemistry leading to the formation of several complex molecular species in space. A comprehensive understanding of the mechanisms involved in these reactions in the ISM necessitates an accurate knowledge of the rate coefficients at the relevant temperatures (10 to 100 K). We present measurements of the rate coefficients for two key reactions below 100 K, which, in both cases, are significantly higher than the values used in astronomical models thus far. The experimental rate coefficients show excellent agreement with dedicated theoretical calculations using a novel ring-polymer molecular dynamics approach that offers a first-principles treatment of low-temperature barrierless gas-phase reactions, which are prevalent in interstellar chemical networks. American Association for the Advancement of Science 2018-06-22 /pmc/articles/PMC6014714/ /pubmed/29942857 http://dx.doi.org/10.1126/sciadv.aar3417 Text en Copyright © 2018 The Authors, some rights reserved; exclusive licensee American Association for the Advancement of Science. No claim to original U.S. Government Works. Distributed under a Creative Commons Attribution NonCommercial License 4.0 (CC BY-NC). http://creativecommons.org/licenses/by-nc/4.0/ This is an open-access article distributed under the terms of the Creative Commons Attribution-NonCommercial license (http://creativecommons.org/licenses/by-nc/4.0/) , which permits use, distribution, and reproduction in any medium, so long as the resultant use is not for commercial advantage and provided the original work is properly cited.
spellingShingle Research Articles
Kumar, Sunil S.
Grussie, Florian
Suleimanov, Yury V.
Guo, Hua
Kreckel, Holger
Low temperature rates for key steps of interstellar gas-phase water formation
title Low temperature rates for key steps of interstellar gas-phase water formation
title_full Low temperature rates for key steps of interstellar gas-phase water formation
title_fullStr Low temperature rates for key steps of interstellar gas-phase water formation
title_full_unstemmed Low temperature rates for key steps of interstellar gas-phase water formation
title_short Low temperature rates for key steps of interstellar gas-phase water formation
title_sort low temperature rates for key steps of interstellar gas-phase water formation
topic Research Articles
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6014714/
https://www.ncbi.nlm.nih.gov/pubmed/29942857
http://dx.doi.org/10.1126/sciadv.aar3417
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