{"id":"https://openalex.org/W4407915556","doi":"https://doi.org/10.3390/sym17030346","title":"Two Quantum Triatomic Hamiltonians: Applications to Non-Adiabatic Effects in NO2 Spectroscopy and in Kr + OH(A2\u03a3+) Electronic Quenching","display_name":"Two Quantum Triatomic Hamiltonians: Applications to Non-Adiabatic Effects in NO2 Spectroscopy and in Kr + OH(A2\u03a3+) Electronic Quenching","publication_year":2025,"publication_date":"2025-02-25","ids":{"openalex":"https://openalex.org/W4407915556","doi":"https://doi.org/10.3390/sym17030346"},"language":"en","primary_location":{"id":"doi:10.3390/sym17030346","is_oa":true,"landing_page_url":"https://doi.org/10.3390/sym17030346","pdf_url":"https://www.mdpi.com/2073-8994/17/3/346/pdf?version=1740483982","source":{"id":"https://openalex.org/S190787756","display_name":"Symmetry","issn_l":"2073-8994","issn":["2073-8994"],"is_oa":true,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310310987","host_organization_name":"Multidisciplinary Digital Publishing Institute","host_organization_lineage":["https://openalex.org/P4310310987"],"host_organization_lineage_names":["Multidisciplinary Digital Publishing Institute"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Symmetry","raw_type":"journal-article"},"type":"article","indexed_in":["crossref"],"open_access":{"is_oa":true,"oa_status":"gold","oa_url":"https://www.mdpi.com/2073-8994/17/3/346/pdf?version=1740483982","any_repository_has_fulltext":false},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5054546893","display_name":"Carlo Petrongolo","orcid":"https://orcid.org/0000-0002-9655-7641"},"institutions":[{"id":"https://openalex.org/I4210154694","display_name":"Institute for Chemical and Physical Processes","ror":"https://ror.org/05patmk97","country_code":"IT","type":"facility","lineage":["https://openalex.org/I4210154694","https://openalex.org/I4210155236"]}],"countries":["IT"],"is_corresponding":true,"raw_author_name":"Carlo Petrongolo","raw_affiliation_strings":["Istituto per i Processi Chimico-Fisici, Consiglio Nazionale delle Ricerche, Via G. Moruzzi 1, 56124 Pisa, Italy"],"affiliations":[{"raw_affiliation_string":"Istituto per i Processi Chimico-Fisici, Consiglio Nazionale delle Ricerche, Via G. Moruzzi 1, 56124 Pisa, Italy","institution_ids":["https://openalex.org/I4210154694"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":1,"corresponding_author_ids":["https://openalex.org/A5054546893"],"corresponding_institution_ids":["https://openalex.org/I4210154694"],"apc_list":{"value":2000,"currency":"CHF","value_usd":2165},"apc_paid":{"value":2000,"currency":"CHF","value_usd":2165},"fwci":0.0,"has_fulltext":false,"cited_by_count":0,"citation_normalized_percentile":{"value":0.03357327,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":null,"biblio":{"volume":"17","issue":"3","first_page":"346","last_page":"346"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10002","display_name":"Advanced Chemical Physics Studies","score":0.9994000196456909,"subfield":{"id":"https://openalex.org/subfields/3107","display_name":"Atomic and Molecular Physics, and Optics"},"field":{"id":"https://openalex.org/fields/31","display_name":"Physics and Astronomy"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T10002","display_name":"Advanced Chemical Physics Studies","score":0.9994000196456909,"subfield":{"id":"https://openalex.org/subfields/3107","display_name":"Atomic and Molecular Physics, and Optics"},"field":{"id":"https://openalex.org/fields/31","display_name":"Physics and Astronomy"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T11177","display_name":"Spectroscopy and Quantum Chemical Studies","score":0.9987999796867371,"subfield":{"id":"https://openalex.org/subfields/3107","display_name":"Atomic and Molecular Physics, and Optics"},"field":{"id":"https://openalex.org/fields/31","display_name":"Physics and Astronomy"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T10913","display_name":"Molecular Junctions and Nanostructures","score":0.9959999918937683,"subfield":{"id":"https://openalex.org/subfields/2208","display_name":"Electrical and Electronic Engineering"},"field":{"id":"https://openalex.org/fields/22","display_name":"Engineering"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/triatomic-molecule","display_name":"Triatomic molecule","score":0.7347443103790283},{"id":"https://openalex.org/keywords/adiabatic-process","display_name":"Adiabatic process","score":0.6847667098045349},{"id":"https://openalex.org/keywords/spectroscopy","display_name":"Spectroscopy","score":0.5644790530204773},{"id":"https://openalex.org/keywords/quenching","display_name":"Quenching (fluorescence)","score":0.5455992221832275},{"id":"https://openalex.org/keywords/atomic-physics","display_name":"Atomic physics","score":0.5295425653457642},{"id":"https://openalex.org/keywords/quantum","display_name":"Quantum","score":0.5060243010520935},{"id":"https://openalex.org/keywords/physics","display_name":"Physics","score":0.46520715951919556},{"id":"https://openalex.org/keywords/electronic-structure","display_name":"Electronic structure","score":0.43469634652137756},{"id":"https://openalex.org/keywords/materials-science","display_name":"Materials science","score":0.3702496290206909},{"id":"https://openalex.org/keywords/quantum-mechanics","display_name":"Quantum mechanics","score":0.29380738735198975},{"id":"https://openalex.org/keywords/molecule","display_name":"Molecule","score":0.11192002892494202},{"id":"https://openalex.org/keywords/fluorescence","display_name":"Fluorescence","score":0.0701184868812561}],"concepts":[{"id":"https://openalex.org/C193201615","wikidata":"https://www.wikidata.org/wiki/Q2788607","display_name":"Triatomic molecule","level":3,"score":0.7347443103790283},{"id":"https://openalex.org/C109663097","wikidata":"https://www.wikidata.org/wiki/Q182453","display_name":"Adiabatic process","level":2,"score":0.6847667098045349},{"id":"https://openalex.org/C32891209","wikidata":"https://www.wikidata.org/wiki/Q483666","display_name":"Spectroscopy","level":2,"score":0.5644790530204773},{"id":"https://openalex.org/C121745418","wikidata":"https://www.wikidata.org/wiki/Q585536","display_name":"Quenching (fluorescence)","level":3,"score":0.5455992221832275},{"id":"https://openalex.org/C184779094","wikidata":"https://www.wikidata.org/wiki/Q26383","display_name":"Atomic physics","level":1,"score":0.5295425653457642},{"id":"https://openalex.org/C84114770","wikidata":"https://www.wikidata.org/wiki/Q46344","display_name":"Quantum","level":2,"score":0.5060243010520935},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.46520715951919556},{"id":"https://openalex.org/C86025842","wikidata":"https://www.wikidata.org/wiki/Q5358432","display_name":"Electronic structure","level":2,"score":0.43469634652137756},{"id":"https://openalex.org/C192562407","wikidata":"https://www.wikidata.org/wiki/Q228736","display_name":"Materials science","level":0,"score":0.3702496290206909},{"id":"https://openalex.org/C62520636","wikidata":"https://www.wikidata.org/wiki/Q944","display_name":"Quantum mechanics","level":1,"score":0.29380738735198975},{"id":"https://openalex.org/C32909587","wikidata":"https://www.wikidata.org/wiki/Q11369","display_name":"Molecule","level":2,"score":0.11192002892494202},{"id":"https://openalex.org/C91881484","wikidata":"https://www.wikidata.org/wiki/Q191807","display_name":"Fluorescence","level":2,"score":0.0701184868812561}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.3390/sym17030346","is_oa":true,"landing_page_url":"https://doi.org/10.3390/sym17030346","pdf_url":"https://www.mdpi.com/2073-8994/17/3/346/pdf?version=1740483982","source":{"id":"https://openalex.org/S190787756","display_name":"Symmetry","issn_l":"2073-8994","issn":["2073-8994"],"is_oa":true,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310310987","host_organization_name":"Multidisciplinary Digital Publishing Institute","host_organization_lineage":["https://openalex.org/P4310310987"],"host_organization_lineage_names":["Multidisciplinary Digital Publishing Institute"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Symmetry","raw_type":"journal-article"}],"best_oa_location":{"id":"doi:10.3390/sym17030346","is_oa":true,"landing_page_url":"https://doi.org/10.3390/sym17030346","pdf_url":"https://www.mdpi.com/2073-8994/17/3/346/pdf?version=1740483982","source":{"id":"https://openalex.org/S190787756","display_name":"Symmetry","issn_l":"2073-8994","issn":["2073-8994"],"is_oa":true,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310310987","host_organization_name":"Multidisciplinary Digital Publishing Institute","host_organization_lineage":["https://openalex.org/P4310310987"],"host_organization_lineage_names":["Multidisciplinary Digital Publishing Institute"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Symmetry","raw_type":"journal-article"},"sustainable_development_goals":[],"awards":[],"funders":[],"has_content":{"grobid_xml":false,"pdf":true},"content_urls":{"pdf":"https://content.openalex.org/works/W4407915556.pdf"},"referenced_works_count":16,"referenced_works":["https://openalex.org/W1969714723","https://openalex.org/W1970940787","https://openalex.org/W1985020534","https://openalex.org/W2008258698","https://openalex.org/W2012042639","https://openalex.org/W2047346265","https://openalex.org/W2049981872","https://openalex.org/W2070976512","https://openalex.org/W2075053313","https://openalex.org/W2113714496","https://openalex.org/W2327889850","https://openalex.org/W2486201974","https://openalex.org/W2887962938","https://openalex.org/W3036696156","https://openalex.org/W3184280615","https://openalex.org/W6722645567"],"related_works":["https://openalex.org/W1640183055","https://openalex.org/W2257390313","https://openalex.org/W2066555339","https://openalex.org/W2056384979","https://openalex.org/W2006807736","https://openalex.org/W1993677904","https://openalex.org/W2268407577","https://openalex.org/W4376489813","https://openalex.org/W956737799","https://openalex.org/W4249952609"],"abstract_inverted_index":{"This":[0],"review":[1],"discusses":[2],"two":[3],"triatomic":[4],"Hamiltonians":[5,153],"and":[6,13,17,43,61,68,86,93,101,113,128,144,147],"their":[7],"applications":[8],"to":[9,49,83],"some":[10],"non-adiabatic":[11,120],"spectroscopic":[12],"collision":[14],"problems.":[15],"Carter":[16],"Handy":[18],"in":[19,25,63,65,72,105],"1984":[20],"presented":[21],"the":[22,36,46,50,73,76,90,98,102,109,148,152],"first":[23],"Hamiltonian":[24,56],"bond":[26],"lengths\u2013bond":[27],"angle":[28],"coordinates,":[29],"that":[30],"is":[31,69,111],"here":[32,70],"applied":[33],"for":[34,134,142],"studying":[35],"NO2":[37],"spectroscopy:":[38],"vibronic":[39],"states,":[40],"internal":[41],"dynamics,":[42],"interaction":[44],"with":[45],"radiation":[47],"due":[48,82],"X\u02dc2A\u2032(A1)\u2212A\u02dc2A\u2032(B2)":[51],"conical":[52,84],"intersection.":[53],"The":[54,125],"second":[55],"was":[57],"reported":[58],"by":[59],"Tennyson":[60],"Sutcliffe":[62],"1983":[64],"Jacobi":[66],"coordinates":[67],"employed":[71],"study":[74,117],"of":[75,118,151],"Kr":[77],"+":[78],"OH(A2\u03a3+)":[79],"electronic":[80,95,107,123],"quenching":[81],"intersection":[85],"Renner\u2013Teller":[87],"interactions":[88,121],"among":[89],"12A\u2032,":[91],"22A\u2032,":[92],"12A\u2033":[94],"species.":[96],"Within":[97],"non-relativistic":[99],"approximation":[100],"expansion":[103],"method":[104],"diabatic":[106],"representations,":[108,137],"formalism":[110],"exact":[112],"allows":[114],"a":[115],"unified":[116],"various":[119],"between":[122],"states.":[124],"rotation,":[126],"inversion,":[127],"nuclear":[129],"permutation":[130],"symmetries":[131],"are":[132,139,154],"considered":[133],"defining":[135],"rovibronic":[136],"which":[138],"symmetry":[140],"adapted":[141],"ABC":[143],"AB2":[145],"molecules,":[146],"matrix":[149],"elements":[150],"then":[155],"computed.":[156]},"counts_by_year":[],"updated_date":"2025-12-19T19:40:27.379048","created_date":"2025-10-10T00:00:00"}