Assignment of the photoelectron spectrum of HCl above 20 eV
Identifieur interne : 003733 ( Istex/Corpus ); précédent : 003732; suivant : 003734Assignment of the photoelectron spectrum of HCl above 20 eV
Auteurs : Miyabi Hiyama ; Suehiro IwataSource :
- Chemical Physics Letters [ 0009-2614 ] ; 1993.
Abstract
The photoelectron spectrum of HCl up to 32 eV is analyzed with ab initio MO Cl calculations. The potential energy curves of most of the highly excited states of the ion HCl+ are correctly drawn to near the dissociation limit, and the Franck-Condon factors (FCF) from the neutral ground state are evaluated. By comparing the experimental spectrum with the theoretical FCF distribution, six observed bands between 20 and 32 eV are assigned. One of them turns out to be a Rydberg state converged to the ground state of HCl2+.
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DOI: 10.1016/0009-2614(93)89122-X
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The potential energy curves of most of the highly excited states of the ion HCl+ are correctly drawn to near the dissociation limit, and the Franck-Condon factors (FCF) from the neutral ground state are evaluated. By comparing the experimental spectrum with the theoretical FCF distribution, six observed bands between 20 and 32 eV are assigned. One of them turns out to be a Rydberg state converged to the ground state of HCl2+.</div></front></TEI><istex><corpusName>elsevier</corpusName><author><json:item><name>Miyabi Hiyama</name><affiliations><json:string>Department of Chemistry, Faculty of Science and Technology, Keio University, Hiyoshi, Kohoku, Yokohama 223, Japan</json:string></affiliations></json:item><json:item><name>Suehiro Iwata</name><affiliations><json:string>Department of Chemistry, Faculty of Science and Technology, Keio University, Hiyoshi, Kohoku, Yokohama 223, Japan</json:string></affiliations></json:item></author><articleId><json:string>9389122X</json:string></articleId><language><json:string>eng</json:string></language><abstract>The photoelectron spectrum of HCl up to 32 eV is analyzed with ab initio MO Cl calculations. The potential energy curves of most of the highly excited states of the ion HCl+ are correctly drawn to near the dissociation limit, and the Franck-Condon factors (FCF) from the neutral ground state are evaluated. By comparing the experimental spectrum with the theoretical FCF distribution, six observed bands between 20 and 32 eV are assigned. One of them turns out to be a Rydberg state converged to the ground state of HCl2+.</abstract><qualityIndicators><score>4.007</score><pdfVersion>1.2</pdfVersion><pdfPageSize>510 x 700 pts</pdfPageSize><refBibsNative>true</refBibsNative><keywordCount>0</keywordCount><abstractCharCount>522</abstractCharCount><pdfWordCount>2939</pdfWordCount><pdfCharCount>17481</pdfCharCount><pdfPageCount>6</pdfPageCount><abstractWordCount>89</abstractWordCount></qualityIndicators><title>Assignment of the photoelectron spectrum of HCl above 20 eV</title><pii><json:string>0009-2614(93)89122-X</json:string></pii><genre><json:string>research-article</json:string></genre><serie><volume>16</volume><editor><json:item><name>H. 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The potential energy curves of most of the highly excited states of the ion HCl+ are correctly drawn to near the dissociation limit, and the Franck-Condon factors (FCF) from the neutral ground state are evaluated. By comparing the experimental spectrum with the theoretical FCF distribution, six observed bands between 20 and 32 eV are assigned. One of them turns out to be a Rydberg state converged to the ground state of HCl2+.</p></abstract></profileDesc><revisionDesc><change when="1993-04-26">Received</change><change when="1993-05-17">Modified</change><change when="1993">Published</change></revisionDesc></teiHeader></istex:fulltextTEI></fulltext><metadata><istex:metadataXml wicri:clean="Elsevier, elements deleted: tail"><istex:xmlDeclaration>version="1.0" encoding="UTF-8"</istex:xmlDeclaration><istex:docType PUBLIC="-//ES//DTD journal article DTD version 4.5.2//EN//XML" URI="art452.dtd" name="istex:docType"></istex:docType><istex:document><converted-article version="4.5.2" docsubtype="fla" xml:lang="en"><item-info><jid>CPLETT</jid><aid>9389122X</aid><ce:pii>0009-2614(93)89122-X</ce:pii><ce:doi>10.1016/0009-2614(93)89122-X</ce:doi><ce:copyright type="unknown" year="1993"></ce:copyright></item-info><head><ce:title>Assignment of the photoelectron spectrum of HCl above 20 eV</ce:title><ce:author-group><ce:author><ce:given-name>Miyabi</ce:given-name><ce:surname>Hiyama</ce:surname></ce:author><ce:author><ce:given-name>Suehiro</ce:given-name><ce:surname>Iwata</ce:surname><ce:cross-ref refid="COR1"><ce:sup loc="post">1</ce:sup></ce:cross-ref></ce:author><ce:affiliation><ce:textfn>Department of Chemistry, Faculty of Science and Technology, Keio University, Hiyoshi, Kohoku, Yokohama 223, Japan</ce:textfn></ce:affiliation><ce:correspondence id="COR1"><ce:label>1</ce:label><ce:text>To whom correspondence should be addressed.</ce:text></ce:correspondence></ce:author-group><ce:date-received day="26" month="4" year="1993"></ce:date-received><ce:date-revised day="17" month="5" year="1993"></ce:date-revised><ce:abstract class="author"><ce:section-title>Abstract</ce:section-title><ce:abstract-sec><ce:simple-para view="all" id="simple-para.0010">The photoelectron spectrum of HCl up to 32 eV is analyzed with ab initio MO Cl calculations. The potential energy curves of most of the highly excited states of the ion HCl<ce:sup loc="post">+</ce:sup> are correctly drawn to near the dissociation limit, and the Franck-Condon factors (FCF) from the neutral ground state are evaluated. By comparing the experimental spectrum with the theoretical FCF distribution, six observed bands between 20 and 32 eV are assigned. One of them turns out to be a Rydberg state converged to the ground state of HCl<ce:sup loc="post">2+</ce:sup>.</ce:simple-para></ce:abstract-sec></ce:abstract></head></converted-article></istex:document></istex:metadataXml><mods version="3.6"><titleInfo lang="en"><title>Assignment of the photoelectron spectrum of HCl above 20 eV</title></titleInfo><titleInfo type="alternative" lang="en" contentType="CDATA"><title>Assignment of the photoelectron spectrum of HCl above 20 eV</title></titleInfo><name type="personal"><namePart type="given">Miyabi</namePart><namePart type="family">Hiyama</namePart><affiliation>Department of Chemistry, Faculty of Science and Technology, Keio University, Hiyoshi, Kohoku, Yokohama 223, Japan</affiliation><role><roleTerm type="text">author</roleTerm></role></name><name type="personal"><namePart type="given">Suehiro</namePart><namePart type="family">Iwata</namePart><affiliation>Department of Chemistry, Faculty of Science and Technology, Keio University, Hiyoshi, Kohoku, Yokohama 223, Japan</affiliation><description>To whom correspondence should be addressed.</description><role><roleTerm type="text">author</roleTerm></role></name><typeOfResource>text</typeOfResource><genre type="research-article" displayLabel="Full-length article"></genre><originInfo><publisher>ELSEVIER</publisher><dateIssued encoding="w3cdtf">1993</dateIssued><dateCaptured encoding="w3cdtf">1993-04-26</dateCaptured><dateModified encoding="w3cdtf">1993-05-17</dateModified><copyrightDate encoding="w3cdtf">1993</copyrightDate></originInfo><language><languageTerm type="code" authority="iso639-2b">eng</languageTerm><languageTerm type="code" authority="rfc3066">en</languageTerm></language><physicalDescription><internetMediaType>text/html</internetMediaType></physicalDescription><abstract lang="en">The photoelectron spectrum of HCl up to 32 eV is analyzed with ab initio MO Cl calculations. The potential energy curves of most of the highly excited states of the ion HCl+ are correctly drawn to near the dissociation limit, and the Franck-Condon factors (FCF) from the neutral ground state are evaluated. By comparing the experimental spectrum with the theoretical FCF distribution, six observed bands between 20 and 32 eV are assigned. One of them turns out to be a Rydberg state converged to the ground state of HCl2+.</abstract><relatedItem type="host"><titleInfo><title>Chemical Physics Letters</title></titleInfo><titleInfo type="abbreviated"><title>CPLETT</title></titleInfo><genre type="Journal">journal</genre><originInfo><dateIssued encoding="w3cdtf">19930723</dateIssued></originInfo><identifier type="ISSN">0009-2614</identifier><identifier type="PII">S0009-2614(00)X1256-0</identifier><part><date>19930723</date><detail type="volume"><number>210</number><caption>vol.</caption></detail><detail type="issue"><number>1–3</number><caption>no.</caption></detail><extent unit="issue pages"><start>1</start><end>306</end></extent><extent unit="pages"><start>187</start><end>192</end></extent></part></relatedItem><identifier type="istex">8E941069447169132196939BE1511B332386539A</identifier><identifier type="DOI">10.1016/0009-2614(93)89122-X</identifier><identifier type="PII">0009-2614(93)89122-X</identifier><identifier type="ArticleID">9389122X</identifier><recordInfo><recordContentSource>ELSEVIER</recordContentSource></recordInfo></mods></metadata><enrichments><istex:refBibTEI uri="https://api.istex.fr/document/8E941069447169132196939BE1511B332386539A/enrichments/refBib"><teiHeader></teiHeader><text><front></front><body></body><back><listBibl><biblStruct><analytic><author><persName><forename type="first">I</forename></persName></author><author><persName><forename type="first">M</forename><forename type="middle">Y</forename><surname>Adam</surname></persName></author><author><persName><forename type="first">S</forename><surname>Svensson</surname></persName></author><author><persName><forename type="first">L</forename><surname>Karisson</surname></persName></author><author><persName><forename type="first">P</forename><surname>Baltzer</surname></persName></author><author><persName><forename type="first">B</forename><surname>Wannberg</surname></persName></author><author><persName><forename type="first">U</forename><surname>Gelius</surname></persName></author><author><persName><forename type="first">M</forename><forename type="middle">Y</forename><surname>Adam</surname></persName></author></analytic><monogr><title level="j">Chem. 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From the above discussion, we may draw the fol-lowing conclusions: ( 1) Two observed broad bands between 22 and 27 eV consist of three series; the peaks at 23.65 eV and 25</title><author><persName><forename type="first">K</forename><surname>Hashimoto</surname></persName></author><author><persName><forename type="first">Y</forename><surname>Osamura</surname></persName></author><author><persName><forename type="first">J</forename><surname>Chcm</surname></persName></author></analytic><monogr><title level="m">85 eV are assigned to the transitions to 2 *C+ and 3 'I+, and the shoulder around 27 eV is the band to the 3 211 state</title></monogr></biblStruct><biblStruct><analytic><author><persName><forename type="first">S</forename><surname>Iwata</surname></persName></author></analytic><monogr><title level="j">Chem. Phys. 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