Publication:
Dynamics of HeHHe(+) rotational state changes induced by collision with He: a possible new path in early universe chemistry

dc.contributor.coauthorGonzález-Sánchez, L.
dc.contributor.coauthorWester, R.
dc.contributor.coauthorGianturco, F. A.
dc.contributor.departmentDepartment of Chemistry
dc.contributor.kuauthorYurtsever, İsmail Ersin
dc.contributor.schoolcollegeinstituteCollege of Sciences
dc.date.accessioned2024-11-09T11:48:45Z
dc.date.issued2021
dc.description.abstractAb initio calculations are employed to generate the rigid rotor (RR) potential energy surface (PES) describing the interaction of the linear molecular cation HeHHe+, at its equilibrium geometry, with the neutral He atom. The resulting interaction is employed to investigate the efficiency of rotational state-changing collisions at the temperatures relevant to the early universe conditions, where the latter molecule has been postulated to exist, albeit not yet observed. The inelastic rate coefficients are found to be fairly large and are compared with those found for another important cation just recently observed in the interstellar medium: the HeH+ polar molecule. The possibility for this cation to provide new options to energy dissipation routes under early universe conditions after the recombination era is briefly discussed.
dc.description.fulltextYES
dc.description.indexedbyWOS
dc.description.indexedbyScopus
dc.description.indexedbyPubMed
dc.description.issue17
dc.description.openaccessYES
dc.description.publisherscopeInternational
dc.description.sponsoredbyTubitakEuN/A
dc.description.sponsorshipAustrian Science Fund (FWF)
dc.description.sponsorshipSpanish Ministry of Science and Innovation
dc.description.versionPublisher version
dc.description.volume125
dc.identifier.doi10.1021/acs.jpca.1c01820
dc.identifier.eissn1520-5215
dc.identifier.embargoNO
dc.identifier.filenameinventorynoIR02873
dc.identifier.issn1089-5639
dc.identifier.quartileN/A
dc.identifier.scopus2-s2.0-85105906548
dc.identifier.urihttps://hdl.handle.net/20.500.14288/620
dc.identifier.wos648873600023
dc.keywordsGas
dc.keywordsScattering
dc.keywordsSpectra
dc.keywordsIons
dc.keywordsSpectroscopy
dc.keywords(HEH+)-HE-4
dc.keywordsClusters
dc.keywordsHydrogen
dc.language.isoeng
dc.publisherAmerican Chemical Society (ACS)
dc.relation.grantno29558-N36
dc.relation.grantnoPGC2018-096444-B-I00
dc.relation.ispartofThe Journal of Physical Chemistry A
dc.relation.urihttp://cdm21054.contentdm.oclc.org/cdm/ref/collection/IR/id/9520
dc.subjectChemistry
dc.subjectPhysics
dc.titleDynamics of HeHHe(+) rotational state changes induced by collision with He: a possible new path in early universe chemistry
dc.typeJournal Article
dspace.entity.typePublication
local.contributor.kuauthorYurtsever, İsmail Ersin
local.publication.orgunit1College of Sciences
local.publication.orgunit2Department of Chemistry
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