Non-ergodic dissociative valence double ionization of SF6

preprint OA: closed
Full text JSON View at publisher

Abstract

Abstract The dissociative double ionization of sulphur hexafluoride, SF6, in the ionization energy range from threshold up to 48.4 eV has been examined in detail using a multiple coincidence electron-ion technique. The results are interpreted by comparison with molecular dynamics simulations, high level molecular structure calculations and with a statistical model of the ion breakdown. Comparison between the experimental breakdown pattern and the pattern derived on the basis of statistical theory indicates that the energy redistribution required for fully statistical behaviour is incomplete on the timescale of the dissociation reactions of SF62+ , suggesting that the molecular size at which ergodic behaviour becomes dominant is larger for doubly and multiply charged ions than for neutral and singly ionized molecules.
Full text 14,000 characters · extracted from preprint-html · click to expand
Non-ergodic dissociative valence double ionization of SF6 | Research Square window.SnipcartSettings = { analytics: { enabled: false } }; (function() { var accessVector = localStorage.getItem('access_vector') || ''; window.dataLayer = window.dataLayer || []; if (accessVector) { window.dataLayer.push({ user: { profile: { profileInfo: { snid: accessVector } } } }); } })(); (function(w,d,s,l,i){w[l]=w[l]||[];w[l].push({'gtm.start':new Date().getTime(),event:'gtm.js'});var f=d.getElementsByTagName(s)[0],j=d.createElement(s),dl=l!='dataLayer'?'&l='+l:'';j.async=true;j.src='https://www.googletagmanager.com/gtm.js?id='+i+dl;f.parentNode.insertBefore(j,f);})(window,document,'script','dataLayer','GTM-K279D39R'); Browse Preprints In Review Journals COVID-19 Preprints AJE Video Bytes Research Tools Research Promotion AJE Professional Editing AJE Rubriq About Preprint Platform In Review Editorial Policies Our Team Advisory Board Help Center Sign In Submit a Preprint Cite Share Download PDF Article Non-ergodic dissociative valence double ionization of SF 6 Raimund Feifel, Emelie Olsson, Veronica Daver Ideböhn, Måns Wallner, and 3 more This is a preprint; it has not been peer reviewed by a journal. https://doi.org/ 10.21203/rs.3.rs-6311485/v1 This work is licensed under a CC BY 4.0 License Status: Published Journal Publication published 01 Jul, 2025 Read the published version in Scientific Reports → Version 1 posted 12 You are reading this latest preprint version Abstract The dissociative double ionization of sulphur hexafluoride, SF 6 , in the ionization energy range from threshold up to 48.4 eV has been examined in detail using a multiple coincidence electron-ion technique. The results are interpreted by comparison with molecular dynamics simulations, high level molecular structure calculations and with a statistical model of the ion breakdown. Comparison between the experimental breakdown pattern and the pattern derived on the basis of statistical theory indicates that the energy redistribution required for fully statistical behaviour is incomplete on the timescale of the dissociation reactions of SF 6 2+ , suggesting that the molecular size at which ergodic behaviour becomes dominant is larger for doubly and multiply charged ions than for neutral and singly ionized molecules. Physical sciences/Physics/Atomic and molecular physics/Atomic and molecular interactions with photons Physical sciences/Physics/Atomic and molecular physics/Electronic structure of atoms and molecules Full Text Additional Declarations No competing interests reported. Supplementary Files SupplementaryMaterials.pdf Cite Share Download PDF Status: Published Journal Publication published 01 Jul, 2025 Read the published version in Scientific Reports → Version 1 posted Editorial decision: Revision requested 04 Jun, 2025 Reviews received at journal 24 May, 2025 Reviewers agreed at journal 12 May, 2025 Reviews received at journal 19 Apr, 2025 Reviews received at journal 15 Apr, 2025 Reviewers agreed at journal 02 Apr, 2025 Reviewers agreed at journal 02 Apr, 2025 Reviewers invited by journal 02 Apr, 2025 Editor assigned by journal 30 Mar, 2025 Editor invited by journal 27 Mar, 2025 Submission checks completed at journal 27 Mar, 2025 First submitted to journal 26 Mar, 2025 You are reading this latest preprint version Research Square lets you share your work early, gain feedback from the community, and start making changes to your manuscript prior to peer review in a journal. As a division of Research Square Company, we’re committed to making research communication faster, fairer, and more useful. We do this by developing innovative software and high quality services for the global research community. Our growing team is made up of researchers and industry professionals working together to solve the most critical problems facing scientific publishing. Also discoverable on Platform About Our Team In Review Editorial Policies Advisory Board Help Center Resources Author Services Accessibility API Access RSS feed Manage Cookie Preferences © Research Square 2026 | ISSN 2693-5015 (online) Privacy Policy Terms of Service Do Not Sell My Personal Information {"props":{"pageProps":{"initialData":{"identity":"rs-6311485","acceptedTermsAndConditions":true,"allowDirectSubmit":false,"archivedVersions":[],"articleType":"Article","associatedPublications":[],"authors":[{"id":445145116,"identity":"7ee4044b-e6fa-44ae-b247-6cab93c9f4de","order_by":0,"name":"Raimund Feifel","email":"data:image/png;base64,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","orcid":"","institution":"University of Gothenburg","correspondingAuthor":true,"prefix":"","firstName":"Raimund","middleName":"","lastName":"Feifel","suffix":""},{"id":445145117,"identity":"ca81beb8-14e1-470c-97a6-cd2954928b99","order_by":1,"name":"Emelie Olsson","email":"","orcid":"","institution":"University of Gothenburg","correspondingAuthor":false,"prefix":"","firstName":"Emelie","middleName":"","lastName":"Olsson","suffix":""},{"id":445145118,"identity":"86f6b956-d296-46a2-89c1-122827216246","order_by":2,"name":"Veronica Daver Ideböhn","email":"","orcid":"","institution":"University of Gothenburg","correspondingAuthor":false,"prefix":"","firstName":"Veronica","middleName":"Daver","lastName":"Ideböhn","suffix":""},{"id":445145119,"identity":"ec385b19-45d9-4d86-b89d-bd0b831eefc7","order_by":3,"name":"Måns Wallner","email":"","orcid":"","institution":"University of Gothenburg","correspondingAuthor":false,"prefix":"","firstName":"Måns","middleName":"","lastName":"Wallner","suffix":""},{"id":445145120,"identity":"f6142a05-c881-42b3-a265-626940ffee1a","order_by":4,"name":"Richard Squibb","email":"","orcid":"","institution":"University of Gothenburg","correspondingAuthor":false,"prefix":"","firstName":"Richard","middleName":"","lastName":"Squibb","suffix":""},{"id":445145121,"identity":"d221e3cb-a8fe-4393-a3d9-06f7aedbc055","order_by":5,"name":"John Eland","email":"","orcid":"","institution":"University of Oxford","correspondingAuthor":false,"prefix":"","firstName":"John","middleName":"","lastName":"Eland","suffix":""},{"id":445145122,"identity":"625759fa-5534-488d-9a6d-e075c60361b0","order_by":6,"name":"Ewa Erdmann","email":"","orcid":"","institution":"Gdańsk University of Technology","correspondingAuthor":false,"prefix":"","firstName":"Ewa","middleName":"","lastName":"Erdmann","suffix":""}],"badges":[],"createdAt":"2025-03-26 10:38:29","currentVersionCode":1,"declarations":"","doi":"10.21203/rs.3.rs-6311485/v1","doiUrl":"https://doi.org/10.21203/rs.3.rs-6311485/v1","draftVersion":[],"editorialEvents":[{"content":"https://doi.org/10.1038/s41598-025-06972-0","type":"published","date":"2025-07-01T15:57:41+00:00"}],"editorialNote":"","failedWorkflow":false,"files":[{"id":86180216,"identity":"1d852a59-b476-48be-816e-d251c19e6286","added_by":"auto","created_at":"2025-07-07 16:21:41","extension":"pdf","order_by":1,"title":"","display":"","copyAsset":false,"role":"manuscript-pdf","size":623716,"visible":true,"origin":"","legend":"","description":"","filename":"Manuscriptsubmit.pdf","url":"https://assets-eu.researchsquare.com/files/rs-6311485/v1_covered_d602362e-edee-4549-b303-6e3dc1cddd49.pdf"},{"id":81180468,"identity":"4676f275-7ad9-4bb0-82e5-009b6039328a","added_by":"auto","created_at":"2025-04-23 07:17:47","extension":"pdf","order_by":1,"title":"","display":"","copyAsset":false,"role":"supplement","size":975269,"visible":true,"origin":"","legend":"","description":"","filename":"SupplementaryMaterials.pdf","url":"https://assets-eu.researchsquare.com/files/rs-6311485/v1/0456c37d9de94a8cc7f610a1.pdf"}],"financialInterests":"No competing interests reported.","formattedTitle":"\u003cp\u003eNon-ergodic dissociative valence double ionization of SF\u003csub\u003e6\u003c/sub\u003e\u003c/p\u003e","fulltext":[],"fulltextSource":"","fullText":"","funders":[],"hasAdminPriorityOnWorkflow":false,"hasManuscriptDocX":false,"hasOptedInToPreprint":true,"hasPassedJournalQc":"","hasAnyPriority":false,"hideJournal":false,"highlight":"","institution":"","isAcceptedByJournal":true,"isAuthorSuppliedPdf":true,"isDeskRejected":"","isHiddenFromSearch":false,"isInQc":false,"isInWorkflow":false,"isPdf":true,"isPdfUpToDate":true,"isWithdrawnOrRetracted":false,"journal":{"display":true,"email":"[email protected]","identity":"scientific-reports","isNatureJournal":false,"hasQc":true,"allowDirectSubmit":false,"externalIdentity":"scirep","sideBox":"Learn more about [Scientific Reports](http://www.nature.com/srep/)","snPcode":"","submissionUrl":"","title":"Scientific Reports","twitterHandle":"","acdcEnabled":true,"dfaEnabled":true,"editorialSystem":"stoa","reportingPortfolio":"Scientific Reports","inReviewEnabled":true,"inReviewRevisionsEnabled":true},"keywords":"","lastPublishedDoi":"10.21203/rs.3.rs-6311485/v1","lastPublishedDoiUrl":"https://doi.org/10.21203/rs.3.rs-6311485/v1","license":{"name":"CC BY 4.0","url":"https://creativecommons.org/licenses/by/4.0/"},"manuscriptAbstract":"\u003cp\u003eThe dissociative double ionization of sulphur hexafluoride, SF\u003csub\u003e6\u003c/sub\u003e, in the ionization energy range from threshold up to 48.4 eV has\u0026nbsp;been examined in detail using a multiple coincidence electron-ion technique. The results are interpreted by comparison with\u0026nbsp;molecular dynamics simulations, high level molecular structure calculations and with a statistical model of the ion breakdown.\u0026nbsp;Comparison between the experimental breakdown pattern and the pattern derived on the basis of statistical theory indicates\u0026nbsp;that the energy redistribution required for fully statistical behaviour is incomplete on the timescale of the dissociation reactions\u0026nbsp;of SF\u003csub\u003e6\u003c/sub\u003e\u003csup\u003e2+\u003c/sup\u003e\u0026nbsp;, suggesting that the molecular size at which ergodic behaviour becomes dominant is larger for doubly and multiply\u0026nbsp;charged ions than for neutral and singly ionized molecules.\u003c/p\u003e","manuscriptTitle":"Non-ergodic dissociative valence double ionization of SF6","msid":"","msnumber":"","nonDraftVersions":[{"code":1,"date":"2025-04-23 07:17:40","doi":"10.21203/rs.3.rs-6311485/v1","editorialEvents":[{"type":"communityComments","content":0},{"type":"decision","content":"Revision requested","date":"2025-06-04T04:17:44+00:00","index":"","fulltext":""},{"type":"editorInvitedReview","content":"","date":"2025-05-24T17:02:38+00:00","index":"hide","fulltext":""},{"type":"reviewerAgreed","content":"294268346162040599820067896260384307038","date":"2025-05-12T14:51:07+00:00","index":"hide","fulltext":""},{"type":"editorInvitedReview","content":"","date":"2025-04-19T13:25:15+00:00","index":"hide","fulltext":""},{"type":"editorInvitedReview","content":"","date":"2025-04-15T17:03:49+00:00","index":"hide","fulltext":""},{"type":"reviewerAgreed","content":"125040653200875094792310418731544661165","date":"2025-04-02T17:14:10+00:00","index":"hide","fulltext":""},{"type":"reviewerAgreed","content":"303226315179850084573924808830812339857","date":"2025-04-02T13:37:48+00:00","index":"hide","fulltext":""},{"type":"reviewersInvited","content":"","date":"2025-04-02T12:54:24+00:00","index":"","fulltext":""},{"type":"editorAssigned","content":"","date":"2025-03-30T15:11:27+00:00","index":"","fulltext":""},{"type":"editorInvited","content":"","date":"2025-03-27T13:35:09+00:00","index":"","fulltext":""},{"type":"checksComplete","content":"","date":"2025-03-27T05:47:45+00:00","index":"","fulltext":""},{"type":"submitted","content":"Scientific Reports","date":"2025-03-26T10:20:43+00:00","index":"","fulltext":""}],"status":"published","journal":{"display":true,"email":"[email protected]","identity":"scientific-reports","isNatureJournal":false,"hasQc":true,"allowDirectSubmit":false,"externalIdentity":"scirep","sideBox":"Learn more about [Scientific Reports](http://www.nature.com/srep/)","snPcode":"","submissionUrl":"","title":"Scientific Reports","twitterHandle":"","acdcEnabled":true,"dfaEnabled":true,"editorialSystem":"stoa","reportingPortfolio":"Scientific Reports","inReviewEnabled":true,"inReviewRevisionsEnabled":true}}],"origin":"","ownerIdentity":"8dadf92e-2364-46fe-84a3-8863d5d05257","owner":[],"postedDate":"April 23rd, 2025","published":true,"recentEditorialEvents":[],"rejectedJournal":[],"revision":"","amendment":"","status":"published-in-journal","subjectAreas":[{"id":47549691,"name":"Physical sciences/Physics/Atomic and molecular physics/Atomic and molecular interactions with photons"},{"id":47549692,"name":"Physical sciences/Physics/Atomic and molecular physics/Electronic structure of atoms and molecules"}],"tags":[],"updatedAt":"2025-07-07T16:15:14+00:00","versionOfRecord":{"articleIdentity":"rs-6311485","link":"https://doi.org/10.1038/s41598-025-06972-0","journal":{"identity":"scientific-reports","isVorOnly":false,"title":"Scientific Reports"},"publishedOn":"2025-07-01 15:57:41","publishedOnDateReadable":"July 1st, 2025"},"versionCreatedAt":"2025-04-23 07:17:40","video":"","vorDoi":"10.1038/s41598-025-06972-0","vorDoiUrl":"https://doi.org/10.1038/s41598-025-06972-0","workflowStages":[]},"version":"v1","identity":"rs-6311485","journalConfig":"researchsquare"},"__N_SSP":true},"page":"/article/[identity]/[[...version]]","query":{"redirect":"/article/rs-6311485","identity":"rs-6311485","version":["v1"]},"buildId":"8U1c8b4HqxoKbykW_rLl7","isFallback":false,"isExperimentalCompile":false,"dynamicIds":[84888],"gssp":true,"scriptLoader":[]}

Text is read by the "Ask this paper" AI Q&A widget below. Extraction quality varies by source — PMC NXML preserves structure cleanly, OA-HTML may include some navigation residue, and OA-PDF can have broken hyphenation. The publisher copy (via DOI) is the canonical version.

My notes (saved in your browser only)

Ask this paper AI returns verbatim quotes from the full text · source: preprint-html

Answers must be backed by verbatim quotes from this paper's full text. Hallucinated quotes are dropped automatically; if no verbatim passage answers the question, we say so. How this works

Citation neighborhood (no data yet)

We don't have any in-corpus citations linked to this paper yet. This is a recent paper (2025) — citers typically take a year or two to land, and the OpenAlex reference graph may still be filling in.

Source provenance

europepmc
last seen: 2026-05-19T01:45:01.086888+00:00