{"id":"https://openalex.org/W2470000725","doi":"https://doi.org/10.1134/s0036023606080146","title":"Study of the structure and stability of aqua complexes Y(H2O)3+n (n = 1\u201310) by Ab initio methods","display_name":"Study of the structure and stability of aqua complexes Y(H2O)3+n (n = 1\u201310) by Ab initio methods","publication_year":2006,"publication_date":"2006-08-01","ids":{"openalex":"https://openalex.org/W2470000725","doi":"https://doi.org/10.1134/s0036023606080146","mag":"2470000725"},"language":"en","primary_location":{"id":"doi:10.1134/s0036023606080146","doi":"https://doi.org/10.1134/s0036023606080146","is_oa":false,"landing_page_url":"https://doi.org/10.1134/s0036023606080146","pdf_url":null,"source":{"id":"https://openalex.org/S127769916","display_name":"Russian Journal of Inorganic Chemistry","issn_l":"0036-0236","issn":["0036-0236","1531-8613","3034-560X"],"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":["dongbi-d","norway-1","poland-40","russia-white-list-2"],"host_organization":"https://openalex.org/P4310320267","host_organization_name":"Pleiades Publishing","host_organization_lineage":["https://openalex.org/P4310320267","https://openalex.org/P4310319965"],"host_organization_lineage_names":["Pleiades Publishing","Springer Nature"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Russian Journal of Inorganic Chemistry","raw_type":"journal-article"},"volume":null,"type":"article","is_traditional":true,"indexed_in":["crossref"],"open_access":{"is_oa":false,"oa_status":"closed","oa_url":null,"any_repository_has_fulltext":false},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5054632701","display_name":"Vladimir Yu. Buzko","orcid":"https://orcid.org/0000-0002-6335-0230","observed_orcids":["https://orcid.org/0000-0002-6335-0230"]},"institutions":[{"id":"https://openalex.org/I117963711","display_name":"Kuban State University","ror":"https://ror.org/01yqewm58","country_code":"RU","type":"education","lineage":["https://openalex.org/I117963711"]}],"countries":["RU"],"is_corresponding":false,"raw_author_name":"V. Yu. Buz\u2019ko","raw_affiliation_strings":["Kuban State University, ul. Karla Libknekhta 9, Krasnodar, 350640, Russia","Kuban State University, Krasnodar, Russia"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Kuban State University, ul. Karla Libknekhta 9, Krasnodar, 350640, Russia","institution_ids":["https://openalex.org/I117963711"]},{"raw_affiliation_string":"Kuban State University, Krasnodar, Russia","institution_ids":["https://openalex.org/I117963711"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5004693361","display_name":"I. V. Sukhno","orcid":"https://orcid.org/0000-0001-7219-5108","observed_orcids":["https://orcid.org/0000-0001-7219-5108"]},"institutions":[{"id":"https://openalex.org/I117963711","display_name":"Kuban State University","ror":"https://ror.org/01yqewm58","country_code":"RU","type":"education","lineage":["https://openalex.org/I117963711"]}],"countries":["RU"],"is_corresponding":false,"raw_author_name":"I. V. Sukhno","raw_affiliation_strings":["Kuban State University, ul. Karla Libknekhta 9, Krasnodar, 350640, Russia","Kuban State University, Krasnodar, Russia"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Kuban State University, ul. Karla Libknekhta 9, Krasnodar, 350640, Russia","institution_ids":["https://openalex.org/I117963711"]},{"raw_affiliation_string":"Kuban State University, Krasnodar, Russia","institution_ids":["https://openalex.org/I117963711"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5000751288","display_name":"M. B. Buz\u2019ko","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I117963711","display_name":"Kuban State University","ror":"https://ror.org/01yqewm58","country_code":"RU","type":"education","lineage":["https://openalex.org/I117963711"]}],"countries":["RU"],"is_corresponding":false,"raw_author_name":"M. B. Buz\u2019ko","raw_affiliation_strings":["Kuban State University, ul. Karla Libknekhta 9, Krasnodar, 350640, Russia","Kuban State University, Krasnodar, Russia"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Kuban State University, ul. Karla Libknekhta 9, Krasnodar, 350640, Russia","institution_ids":["https://openalex.org/I117963711"]},{"raw_affiliation_string":"Kuban State University, Krasnodar, Russia","institution_ids":["https://openalex.org/I117963711"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5112188369","display_name":"\u0410. \u0410. \u041f\u043e\u043b\u0443\u0448\u0438\u043d","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I117963711","display_name":"Kuban State University","ror":"https://ror.org/01yqewm58","country_code":"RU","type":"education","lineage":["https://openalex.org/I117963711"]}],"countries":["RU"],"is_corresponding":false,"raw_author_name":"A. A. Polushin","raw_affiliation_strings":["Kuban State University, ul. Karla Libknekhta 9, Krasnodar, 350640, Russia","Kuban State University, Krasnodar, Russia"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Kuban State University, ul. Karla Libknekhta 9, Krasnodar, 350640, Russia","institution_ids":["https://openalex.org/I117963711"]},{"raw_affiliation_string":"Kuban State University, Krasnodar, Russia","institution_ids":["https://openalex.org/I117963711"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5039305820","display_name":"V. T. Panyushkin","orcid":"https://orcid.org/0000-0002-7858-8823","observed_orcids":["https://orcid.org/0000-0002-7858-8823"]},"institutions":[{"id":"https://openalex.org/I117963711","display_name":"Kuban State University","ror":"https://ror.org/01yqewm58","country_code":"RU","type":"education","lineage":["https://openalex.org/I117963711"]}],"countries":["RU"],"is_corresponding":false,"raw_author_name":"V. T. Panyushkin","raw_affiliation_strings":["Kuban State University, ul. Karla Libknekhta 9, Krasnodar, 350640, Russia","Kuban State University, Krasnodar, Russia"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Kuban State University, ul. Karla Libknekhta 9, Krasnodar, 350640, Russia","institution_ids":["https://openalex.org/I117963711"]},{"raw_affiliation_string":"Kuban State University, Krasnodar, Russia","institution_ids":["https://openalex.org/I117963711"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":1,"corresponding_author_ids":[],"corresponding_institution_ids":["https://openalex.org/I117963711"],"apc_list":null,"apc_paid":null,"fwci":0.1867,"has_fulltext":false,"cited_by_count":3,"citation_normalized_percentile":{"value":0.46374041,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":null,"biblio":{"volume":"51","issue":"8","first_page":"1276","last_page":"1282"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10002","display_name":"Advanced Chemical Physics Studies","score":0.951200008392334,"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":0.951200008392334,"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":0.014999999664723873,"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/T12044","display_name":"Advanced Physical and Chemical Molecular Interactions","score":0.004800000227987766,"subfield":{"id":"https://openalex.org/subfields/1606","display_name":"Physical and Theoretical Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/water-coordination","display_name":"water coordination","score":0.44600000977516174},{"id":"https://openalex.org/keywords/complex-stability","display_name":"complex stability","score":0.7120000123977661},{"id":"https://openalex.org/keywords/coordination-number","display_name":"coordination number","score":0.4729999899864197},{"id":"https://openalex.org/keywords/energy-characteristics","display_name":"energy characteristics","score":0.32199999690055847}],"concepts":[{"id":"https://openalex.org/C2781442258","wikidata":"https://www.wikidata.org/wiki/Q46310","display_name":"Ab initio","level":2,"score":0.6639724373817444},{"id":"https://openalex.org/C112972136","wikidata":"https://www.wikidata.org/wiki/Q7595718","display_name":"Stability (learning theory)","level":2,"score":0.5568764209747314},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.48736435174942017},{"id":"https://openalex.org/C147597530","wikidata":"https://www.wikidata.org/wiki/Q369472","display_name":"Computational chemistry","level":1,"score":0.4753251373767853},{"id":"https://openalex.org/C8010536","wikidata":"https://www.wikidata.org/wiki/Q160398","display_name":"Crystallography","level":1,"score":0.4346325993537903},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.12755420804023743},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.08841106295585632},{"id":"https://openalex.org/C119857082","wikidata":"https://www.wikidata.org/wiki/Q2539","display_name":"Machine learning","level":1,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1134/s0036023606080146","doi":"https://doi.org/10.1134/s0036023606080146","is_oa":false,"landing_page_url":"https://doi.org/10.1134/s0036023606080146","pdf_url":null,"source":{"id":"https://openalex.org/S127769916","display_name":"Russian Journal of Inorganic Chemistry","issn_l":"0036-0236","issn":["0036-0236","1531-8613","3034-560X"],"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":["dongbi-d","norway-1","poland-40","russia-white-list-2"],"host_organization":"https://openalex.org/P4310320267","host_organization_name":"Pleiades Publishing","host_organization_lineage":["https://openalex.org/P4310320267","https://openalex.org/P4310319965"],"host_organization_lineage_names":["Pleiades Publishing","Springer Nature"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Russian Journal of Inorganic Chemistry","raw_type":"journal-article"}],"best_oa_location":null,"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":37,"referenced_works":["https://openalex.org/W1597318091","https://openalex.org/W1611952678","https://openalex.org/W1974595953","https://openalex.org/W1976159832","https://openalex.org/W1976874538","https://openalex.org/W1979915840","https://openalex.org/W1984187920","https://openalex.org/W1985002156","https://openalex.org/W1989916575","https://openalex.org/W1993461592","https://openalex.org/W1999786771","https://openalex.org/W2017674035","https://openalex.org/W2032602063","https://openalex.org/W2042276233","https://openalex.org/W2043327592","https://openalex.org/W2045959204","https://openalex.org/W2048295697","https://openalex.org/W2050303294","https://openalex.org/W2063686867","https://openalex.org/W2065710861","https://openalex.org/W2068617439","https://openalex.org/W2070860844","https://openalex.org/W2072072145","https://openalex.org/W2072678408","https://openalex.org/W2079047624","https://openalex.org/W2085434575","https://openalex.org/W2091117606","https://openalex.org/W2116103293","https://openalex.org/W2132905138","https://openalex.org/W2164707059","https://openalex.org/W2286402374","https://openalex.org/W2481265615","https://openalex.org/W2484356044","https://openalex.org/W4238512449","https://openalex.org/W4243441031","https://openalex.org/W4246613691","https://openalex.org/W4249173384"],"related_works":["https://openalex.org/W2066457346","https://openalex.org/W2465538228","https://openalex.org/W2044477091","https://openalex.org/W2258520244","https://openalex.org/W2039273991","https://openalex.org/W2079607615","https://openalex.org/W2070376073","https://openalex.org/W2047171205","https://openalex.org/W2921548153","https://openalex.org/W4234177867"],"abstract_inverted_index":{"The":[0],"structural":[1],"and":[2,22],"energetic":[3],"characteristics":[4],"of":[5],"aqua":[6],"complexes":[7],"Y(H2O)":[8],"n":[9],"3+":[10],"(n":[11],"=":[12],"1\u201310)":[13],"have":[14],"been":[15],"calculated":[16],"by":[17],"the":[18],"ab":[19],"initio":[20],"RHF":[21],"MP2":[23],"methods.":[24]},"counts_by_year":[],"updated_date":"2026-09-22T06:50:58.402377","created_date":"2016-07-22T00:00:00"}
