{"id":"https://openalex.org/W1987958313","doi":"https://doi.org/10.1002/jcc.540140507","title":"Study of localized molecular orbitals using group theory methods and its approach to the many\u2010electron correlation problem. III. Orthogonal bonded functions","display_name":"Study of localized molecular orbitals using group theory methods and its approach to the many\u2010electron correlation problem. III. Orthogonal bonded functions","publication_year":1993,"publication_date":"1993-05-01","ids":{"openalex":"https://openalex.org/W1987958313","doi":"https://doi.org/10.1002/jcc.540140507","mag":"1987958313"},"language":"en","primary_location":{"id":"doi:10.1002/jcc.540140507","is_oa":false,"landing_page_url":"https://doi.org/10.1002/jcc.540140507","pdf_url":null,"source":{"id":"https://openalex.org/S21117631","display_name":"Journal of Computational Chemistry","issn_l":"0192-8651","issn":["0192-8651","1096-987X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310320595","host_organization_name":"Wiley","host_organization_lineage":["https://openalex.org/P4310320595"],"host_organization_lineage_names":["Wiley"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Computational Chemistry","raw_type":"journal-article"},"type":"article","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/A5055207791","display_name":"Taijin Zhou","orcid":null},"institutions":[{"id":"https://openalex.org/I191208505","display_name":"Xiamen University","ror":"https://ror.org/00mcjh785","country_code":"CN","type":"education","lineage":["https://openalex.org/I191208505"]}],"countries":["CN"],"is_corresponding":true,"raw_author_name":"Taijin Zhou","raw_affiliation_strings":["Department of Chemistry, Xiamen University, Xiamen, China","Department of Chemistry Xiamen University Xiamen CHINA"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, Xiamen University, Xiamen, China","institution_ids":["https://openalex.org/I191208505"]},{"raw_affiliation_string":"Department of Chemistry Xiamen University Xiamen CHINA","institution_ids":["https://openalex.org/I191208505"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":1,"corresponding_author_ids":["https://openalex.org/A5055207791"],"corresponding_institution_ids":["https://openalex.org/I191208505"],"apc_list":{"value":4840,"currency":"USD","value_usd":4840},"apc_paid":null,"fwci":1.0077,"has_fulltext":false,"cited_by_count":5,"citation_normalized_percentile":{"value":0.69201533,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":null,"biblio":{"volume":"14","issue":"5","first_page":"549","last_page":"555"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T11746","display_name":"Inorganic and Organometallic Chemistry","score":0.9950000047683716,"subfield":{"id":"https://openalex.org/subfields/1605","display_name":"Organic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T11746","display_name":"Inorganic and Organometallic Chemistry","score":0.9950000047683716,"subfield":{"id":"https://openalex.org/subfields/1605","display_name":"Organic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"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":0.9932000041007996,"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"}},{"id":"https://openalex.org/T12613","display_name":"X-ray Diffraction in Crystallography","score":0.9930999875068665,"subfield":{"id":"https://openalex.org/subfields/2505","display_name":"Materials Chemistry"},"field":{"id":"https://openalex.org/fields/25","display_name":"Materials Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/atomic-orbital","display_name":"Atomic orbital","score":0.711485743522644},{"id":"https://openalex.org/keywords/complete-active-space","display_name":"Complete active space","score":0.6946300864219666},{"id":"https://openalex.org/keywords/molecular-orbital","display_name":"Molecular orbital","score":0.677427351474762},{"id":"https://openalex.org/keywords/wave-function","display_name":"Wave function","score":0.6248867511749268},{"id":"https://openalex.org/keywords/molecular-orbital-theory","display_name":"Molecular orbital theory","score":0.6095266342163086},{"id":"https://openalex.org/keywords/group","display_name":"Group (periodic table)","score":0.5719332695007324},{"id":"https://openalex.org/keywords/slater-type-orbital","display_name":"Slater-type orbital","score":0.48555752635002136},{"id":"https://openalex.org/keywords/symmetry","display_name":"Symmetry (geometry)","score":0.4819307327270508},{"id":"https://openalex.org/keywords/localized-molecular-orbitals","display_name":"Localized molecular orbitals","score":0.47913166880607605},{"id":"https://openalex.org/keywords/space","display_name":"Space (punctuation)","score":0.46896588802337646},{"id":"https://openalex.org/keywords/electron","display_name":"Electron","score":0.4511874318122864},{"id":"https://openalex.org/keywords/quantum-mechanics","display_name":"Quantum mechanics","score":0.4367668032646179},{"id":"https://openalex.org/keywords/electronic-correlation","display_name":"Electronic correlation","score":0.4362073540687561},{"id":"https://openalex.org/keywords/physics","display_name":"Physics","score":0.417195200920105},{"id":"https://openalex.org/keywords/computational-chemistry","display_name":"Computational chemistry","score":0.3773237466812134},{"id":"https://openalex.org/keywords/atomic-physics","display_name":"Atomic physics","score":0.34796303510665894},{"id":"https://openalex.org/keywords/chemistry","display_name":"Chemistry","score":0.3465661406517029},{"id":"https://openalex.org/keywords/mathematics","display_name":"Mathematics","score":0.2314840853214264},{"id":"https://openalex.org/keywords/molecule","display_name":"Molecule","score":0.18574070930480957},{"id":"https://openalex.org/keywords/computer-science","display_name":"Computer science","score":0.17340970039367676},{"id":"https://openalex.org/keywords/geometry","display_name":"Geometry","score":0.09896859526634216}],"concepts":[{"id":"https://openalex.org/C189394030","wikidata":"https://www.wikidata.org/wiki/Q53860","display_name":"Atomic orbital","level":3,"score":0.711485743522644},{"id":"https://openalex.org/C41455181","wikidata":"https://www.wikidata.org/wiki/Q1062109","display_name":"Complete active space","level":4,"score":0.6946300864219666},{"id":"https://openalex.org/C139358910","wikidata":"https://www.wikidata.org/wiki/Q725417","display_name":"Molecular orbital","level":3,"score":0.677427351474762},{"id":"https://openalex.org/C113603373","wikidata":"https://www.wikidata.org/wiki/Q2362761","display_name":"Wave function","level":2,"score":0.6248867511749268},{"id":"https://openalex.org/C193772553","wikidata":"https://www.wikidata.org/wiki/Q898432","display_name":"Molecular orbital theory","level":4,"score":0.6095266342163086},{"id":"https://openalex.org/C2781311116","wikidata":"https://www.wikidata.org/wiki/Q83306","display_name":"Group (periodic table)","level":2,"score":0.5719332695007324},{"id":"https://openalex.org/C80062241","wikidata":"https://www.wikidata.org/wiki/Q904125","display_name":"Slater-type orbital","level":5,"score":0.48555752635002136},{"id":"https://openalex.org/C2779886137","wikidata":"https://www.wikidata.org/wiki/Q21030012","display_name":"Symmetry (geometry)","level":2,"score":0.4819307327270508},{"id":"https://openalex.org/C38823869","wikidata":"https://www.wikidata.org/wiki/Q6664649","display_name":"Localized molecular orbitals","level":5,"score":0.47913166880607605},{"id":"https://openalex.org/C2778572836","wikidata":"https://www.wikidata.org/wiki/Q380933","display_name":"Space (punctuation)","level":2,"score":0.46896588802337646},{"id":"https://openalex.org/C147120987","wikidata":"https://www.wikidata.org/wiki/Q2225","display_name":"Electron","level":2,"score":0.4511874318122864},{"id":"https://openalex.org/C62520636","wikidata":"https://www.wikidata.org/wiki/Q944","display_name":"Quantum mechanics","level":1,"score":0.4367668032646179},{"id":"https://openalex.org/C35052450","wikidata":"https://www.wikidata.org/wiki/Q2733663","display_name":"Electronic correlation","level":3,"score":0.4362073540687561},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.417195200920105},{"id":"https://openalex.org/C147597530","wikidata":"https://www.wikidata.org/wiki/Q369472","display_name":"Computational chemistry","level":1,"score":0.3773237466812134},{"id":"https://openalex.org/C184779094","wikidata":"https://www.wikidata.org/wiki/Q26383","display_name":"Atomic physics","level":1,"score":0.34796303510665894},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.3465661406517029},{"id":"https://openalex.org/C33923547","wikidata":"https://www.wikidata.org/wiki/Q395","display_name":"Mathematics","level":0,"score":0.2314840853214264},{"id":"https://openalex.org/C32909587","wikidata":"https://www.wikidata.org/wiki/Q11369","display_name":"Molecule","level":2,"score":0.18574070930480957},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.17340970039367676},{"id":"https://openalex.org/C2524010","wikidata":"https://www.wikidata.org/wiki/Q8087","display_name":"Geometry","level":1,"score":0.09896859526634216},{"id":"https://openalex.org/C111919701","wikidata":"https://www.wikidata.org/wiki/Q9135","display_name":"Operating system","level":1,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1002/jcc.540140507","is_oa":false,"landing_page_url":"https://doi.org/10.1002/jcc.540140507","pdf_url":null,"source":{"id":"https://openalex.org/S21117631","display_name":"Journal of Computational Chemistry","issn_l":"0192-8651","issn":["0192-8651","1096-987X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310320595","host_organization_name":"Wiley","host_organization_lineage":["https://openalex.org/P4310320595"],"host_organization_lineage_names":["Wiley"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Computational Chemistry","raw_type":"journal-article"}],"best_oa_location":null,"sustainable_development_goals":[],"awards":[],"funders":[],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":37,"referenced_works":["https://openalex.org/W1513380832","https://openalex.org/W1548908539","https://openalex.org/W1586615196","https://openalex.org/W1964135534","https://openalex.org/W1968923794","https://openalex.org/W1984943783","https://openalex.org/W1985211641","https://openalex.org/W1985562389","https://openalex.org/W1994220577","https://openalex.org/W1995362791","https://openalex.org/W2000187645","https://openalex.org/W2002023260","https://openalex.org/W2002671160","https://openalex.org/W2004418875","https://openalex.org/W2006319812","https://openalex.org/W2015438457","https://openalex.org/W2015461021","https://openalex.org/W2029453509","https://openalex.org/W2029658409","https://openalex.org/W2036072765","https://openalex.org/W2037003422","https://openalex.org/W2045541755","https://openalex.org/W2054880001","https://openalex.org/W2055454137","https://openalex.org/W2055649238","https://openalex.org/W2058779676","https://openalex.org/W2060886877","https://openalex.org/W2065464306","https://openalex.org/W2068189426","https://openalex.org/W2068607512","https://openalex.org/W2091133863","https://openalex.org/W2092120591","https://openalex.org/W2101147233","https://openalex.org/W2491403645","https://openalex.org/W4234202691","https://openalex.org/W4237952335","https://openalex.org/W4242577369"],"related_works":["https://openalex.org/W1970102618","https://openalex.org/W2017618268","https://openalex.org/W4245636024","https://openalex.org/W2056483287","https://openalex.org/W3185764483","https://openalex.org/W1978465803","https://openalex.org/W2032587958","https://openalex.org/W3160119635","https://openalex.org/W2070380429","https://openalex.org/W2891464718"],"abstract_inverted_index":{"Abstract":[0],"By":[1],"using":[2],"the":[3,18,46],"group":[4],"symmetrical":[5],"localized":[6],"molecular":[7],"orbitals":[8,12],"(SLMOs)":[9],"as":[10,33],"configuration\u2010generating":[11],"(CGOs)":[13],"of":[14,21,48],"many\u2010electron":[15,22],"wave":[16],"functions,":[17],"symmetry":[19],"adaptation":[20],"spaces":[23],"is":[24],"greatly":[25],"simplified,":[26],"and":[27,36],"novel":[28],"orthogonal":[29],"bonded":[30],"functions":[31],"(OBFs),":[32],"complete":[34],"space\u2010":[35],"spin\u2010adapted":[37],"antisymmetrized":[38],"products,":[39],"are":[40,50],"introduced.":[41],"The":[42],"corresponding":[43],"programs":[44],"for":[45],"solutions":[47],"OBFs":[49],"developed.":[51],"\u00a9":[52],"1993":[53],"John":[54],"Wiley":[55],"&":[56],"Sons,":[57],"Inc.":[58]},"counts_by_year":[],"updated_date":"2026-05-21T06:26:12.895304","created_date":"2025-10-10T00:00:00"}