{"id":"https://openalex.org/W2079646868","doi":"https://doi.org/10.1016/j.orgel.2013.05.032","title":"Large face to face tetraphenylporphyrin/fullerene nanoaggregates. A DFT study","display_name":"Large face to face tetraphenylporphyrin/fullerene nanoaggregates. A DFT study","publication_year":2013,"publication_date":"2013-06-12","ids":{"openalex":"https://openalex.org/W2079646868","doi":"https://doi.org/10.1016/j.orgel.2013.05.032","mag":"2079646868"},"language":"en","primary_location":{"id":"doi:10.1016/j.orgel.2013.05.032","doi":"https://doi.org/10.1016/j.orgel.2013.05.032","is_oa":false,"landing_page_url":"https://doi.org/10.1016/j.orgel.2013.05.032","pdf_url":null,"source":{"id":"https://openalex.org/S99846442","display_name":"Organic Electronics","issn_l":"1566-1199","issn":["1566-1199","1878-5530"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-b","jufo-2","ki-jl-1","norway-1","poland-100","russia-white-list-1","vabb-shw"],"host_organization":"https://openalex.org/P4310320990","host_organization_name":"Elsevier BV","host_organization_lineage":["https://openalex.org/P4310320990"],"host_organization_lineage_names":["Elsevier BV"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Organic Electronics","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/A5017797846","display_name":"Ulises Jim\u00e9nez Castillo","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I8961855","display_name":"Universidad Nacional Aut\u00f3noma de M\u00e9xico","ror":"https://ror.org/01tmp8f25","country_code":"MX","type":"education","lineage":["https://openalex.org/I8961855"]}],"countries":["MX"],"is_corresponding":false,"raw_author_name":"Ulises Jim\u00e9nez Castillo","raw_affiliation_strings":["Instituto de Investigaciones en Materiales, Universidad Nacional Aut\u00f3noma de M\u00e9xico, Apartado Postal 70-360, CU, Coyoac\u00e1n, Mexico DF 04510, Mexico"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Instituto de Investigaciones en Materiales, Universidad Nacional Aut\u00f3noma de M\u00e9xico, Apartado Postal 70-360, CU, Coyoac\u00e1n, Mexico DF 04510, Mexico","institution_ids":["https://openalex.org/I8961855"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5047225542","display_name":"Patricia Guadarrama","orcid":"https://orcid.org/0000-0002-4142-119X","observed_orcids":["https://orcid.org/0000-0002-4142-119X"]},"institutions":[{"id":"https://openalex.org/I8961855","display_name":"Universidad Nacional Aut\u00f3noma de M\u00e9xico","ror":"https://ror.org/01tmp8f25","country_code":"MX","type":"education","lineage":["https://openalex.org/I8961855"]}],"countries":["MX"],"is_corresponding":false,"raw_author_name":"Patricia Guadarrama","raw_affiliation_strings":["Instituto de Investigaciones en Materiales, Universidad Nacional Aut\u00f3noma de M\u00e9xico, Apartado Postal 70-360, CU, Coyoac\u00e1n, Mexico DF 04510, Mexico"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Instituto de Investigaciones en Materiales, Universidad Nacional Aut\u00f3noma de M\u00e9xico, Apartado Postal 70-360, CU, Coyoac\u00e1n, Mexico DF 04510, Mexico","institution_ids":["https://openalex.org/I8961855"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5085613468","display_name":"Serguei M. Fomine","orcid":"https://orcid.org/0000-0002-7068-7579","observed_orcids":["https://orcid.org/0000-0002-7068-7579"]},"institutions":[{"id":"https://openalex.org/I8961855","display_name":"Universidad Nacional Aut\u00f3noma de M\u00e9xico","ror":"https://ror.org/01tmp8f25","country_code":"MX","type":"education","lineage":["https://openalex.org/I8961855"]}],"countries":["MX"],"is_corresponding":true,"raw_author_name":"Serguei Fomine","raw_affiliation_strings":["Instituto de Investigaciones en Materiales, Universidad Nacional Aut\u00f3noma de M\u00e9xico, Apartado Postal 70-360, CU, Coyoac\u00e1n, Mexico DF 04510, Mexico"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Instituto de Investigaciones en Materiales, Universidad Nacional Aut\u00f3noma de M\u00e9xico, Apartado Postal 70-360, CU, Coyoac\u00e1n, Mexico DF 04510, Mexico","institution_ids":["https://openalex.org/I8961855"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":1,"corresponding_author_ids":["https://openalex.org/A5085613468"],"corresponding_institution_ids":["https://openalex.org/I8961855"],"apc_list":{"value":3650,"currency":"USD","value_usd":3650},"apc_paid":null,"fwci":1.5288,"has_fulltext":false,"cited_by_count":16,"citation_normalized_percentile":{"value":0.80287361,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":87,"max":98},"biblio":{"volume":"14","issue":"10","first_page":"2617","last_page":"2627"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10956","display_name":"Fullerene Chemistry and Applications","score":0.6226000189781189,"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/T10956","display_name":"Fullerene Chemistry and Applications","score":0.6226000189781189,"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/T10903","display_name":"Porphyrin and Phthalocyanine Chemistry","score":0.3319999873638153,"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"}},{"id":"https://openalex.org/T10045","display_name":"Organic Electronics and Photovoltaics","score":0.0203000009059906,"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/tetraphenylporphyrin","display_name":"tetraphenylporphyrin","score":0.9860000014305115},{"id":"https://openalex.org/keywords/c60","display_name":"C60","score":0.9449999928474426},{"id":"https://openalex.org/keywords/zinc-porphyrin","display_name":"zinc porphyrin","score":0.7639999985694885},{"id":"https://openalex.org/keywords/dispersion-interactions","display_name":"dispersion interactions","score":0.7229999899864197},{"id":"https://openalex.org/keywords/binding-energy","display_name":"binding energy","score":0.9729999899864197},{"id":"https://openalex.org/keywords/band-gap","display_name":"band gap","score":0.7820000052452087},{"id":"https://openalex.org/keywords/charge-transfer","display_name":"charge transfer","score":0.7319999933242798},{"id":"https://openalex.org/keywords/reorganization-energy","display_name":"reorganization energy","score":0.9490000009536743},{"id":"https://openalex.org/keywords/ionization-potential","display_name":"ionization potential","score":0.8050000071525574},{"id":"https://openalex.org/keywords/electron-affinity","display_name":"electron affinity","score":0.9779999852180481},{"id":"https://openalex.org/keywords/electron-and-hole-transport","display_name":"electron and hole transport","score":0.5879999995231628},{"id":"https://openalex.org/keywords/charge-transfer-complexes","display_name":"charge-transfer complexes","score":0.5339999794960022}],"concepts":[{"id":"https://openalex.org/C2778401137","wikidata":"https://www.wikidata.org/wiki/Q3985292","display_name":"Tetraphenylporphyrin","level":3,"score":0.9257422685623169},{"id":"https://openalex.org/C70050531","wikidata":"https://www.wikidata.org/wiki/Q899089","display_name":"Delocalized electron","level":2,"score":0.8816288709640503},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.7093688249588013},{"id":"https://openalex.org/C64127065","wikidata":"https://www.wikidata.org/wiki/Q1074844","display_name":"Polaron","level":3,"score":0.6959952116012573},{"id":"https://openalex.org/C93282013","wikidata":"https://www.wikidata.org/wiki/Q420754","display_name":"Binding energy","level":2,"score":0.5603031516075134},{"id":"https://openalex.org/C177562468","wikidata":"https://www.wikidata.org/wiki/Q182893","display_name":"Dispersion (optics)","level":2,"score":0.5470423102378845},{"id":"https://openalex.org/C162862793","wikidata":"https://www.wikidata.org/wiki/Q178026","display_name":"Fullerene","level":2,"score":0.5300445556640625},{"id":"https://openalex.org/C544153396","wikidata":"https://www.wikidata.org/wiki/Q11426","display_name":"Metal","level":2,"score":0.46961337327957153},{"id":"https://openalex.org/C181966813","wikidata":"https://www.wikidata.org/wiki/Q806352","display_name":"Band gap","level":2,"score":0.4378434419631958},{"id":"https://openalex.org/C75473681","wikidata":"https://www.wikidata.org/wiki/Q188651","display_name":"Photochemistry","level":1,"score":0.3645504415035248},{"id":"https://openalex.org/C159467904","wikidata":"https://www.wikidata.org/wiki/Q2001702","display_name":"Chemical physics","level":1,"score":0.36313506960868835},{"id":"https://openalex.org/C147597530","wikidata":"https://www.wikidata.org/wiki/Q369472","display_name":"Computational chemistry","level":1,"score":0.3567262887954712},{"id":"https://openalex.org/C147120987","wikidata":"https://www.wikidata.org/wiki/Q2225","display_name":"Electron","level":2,"score":0.3363994061946869},{"id":"https://openalex.org/C184779094","wikidata":"https://www.wikidata.org/wiki/Q26383","display_name":"Atomic physics","level":1,"score":0.20491060614585876},{"id":"https://openalex.org/C192562407","wikidata":"https://www.wikidata.org/wiki/Q228736","display_name":"Materials science","level":0,"score":0.18819865584373474},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.09752994775772095},{"id":"https://openalex.org/C49040817","wikidata":"https://www.wikidata.org/wiki/Q193091","display_name":"Optoelectronics","level":1,"score":0.07078936696052551},{"id":"https://openalex.org/C2779480358","wikidata":"https://www.wikidata.org/wiki/Q422926","display_name":"Porphyrin","level":2,"score":0.06656825542449951},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.0},{"id":"https://openalex.org/C62520636","wikidata":"https://www.wikidata.org/wiki/Q944","display_name":"Quantum mechanics","level":1,"score":0.0},{"id":"https://openalex.org/C120665830","wikidata":"https://www.wikidata.org/wiki/Q14620","display_name":"Optics","level":1,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1016/j.orgel.2013.05.032","doi":"https://doi.org/10.1016/j.orgel.2013.05.032","is_oa":false,"landing_page_url":"https://doi.org/10.1016/j.orgel.2013.05.032","pdf_url":null,"source":{"id":"https://openalex.org/S99846442","display_name":"Organic Electronics","issn_l":"1566-1199","issn":["1566-1199","1878-5530"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-b","jufo-2","ki-jl-1","norway-1","poland-100","russia-white-list-1","vabb-shw"],"host_organization":"https://openalex.org/P4310320990","host_organization_name":"Elsevier BV","host_organization_lineage":["https://openalex.org/P4310320990"],"host_organization_lineage_names":["Elsevier BV"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Organic Electronics","raw_type":"journal-article"}],"best_oa_location":null,"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":43,"referenced_works":["https://openalex.org/W599002060","https://openalex.org/W1634461832","https://openalex.org/W1965152327","https://openalex.org/W1968609032","https://openalex.org/W1973102921","https://openalex.org/W1978085924","https://openalex.org/W1981368803","https://openalex.org/W1983152550","https://openalex.org/W1989854295","https://openalex.org/W1992380848","https://openalex.org/W1994653827","https://openalex.org/W2005376562","https://openalex.org/W2021358747","https://openalex.org/W2048508129","https://openalex.org/W2054704030","https://openalex.org/W2054959845","https://openalex.org/W2061022152","https://openalex.org/W2061306570","https://openalex.org/W2062852634","https://openalex.org/W2065538727","https://openalex.org/W2066909408","https://openalex.org/W2068411157","https://openalex.org/W2069560513","https://openalex.org/W2077965852","https://openalex.org/W2082866465","https://openalex.org/W2086181997","https://openalex.org/W2090228833","https://openalex.org/W2092157292","https://openalex.org/W2094213387","https://openalex.org/W2100077118","https://openalex.org/W2111859844","https://openalex.org/W2117819030","https://openalex.org/W2122047873","https://openalex.org/W2123582815","https://openalex.org/W2130181596","https://openalex.org/W2141253546","https://openalex.org/W2145216343","https://openalex.org/W2150195378","https://openalex.org/W2153725699","https://openalex.org/W2160936791","https://openalex.org/W2949409696","https://openalex.org/W2950332593","https://openalex.org/W6636887199"],"related_works":["https://openalex.org/W2065744460","https://openalex.org/W2031324284","https://openalex.org/W2767855044","https://openalex.org/W7124438336","https://openalex.org/W4413912180","https://openalex.org/W7128923730","https://openalex.org/W2727083982","https://openalex.org/W2945094365","https://openalex.org/W2792136500","https://openalex.org/W2086757909"],"abstract_inverted_index":null,"counts_by_year":[{"year":2021,"cited_by_count":1},{"year":2018,"cited_by_count":3},{"year":2017,"cited_by_count":1},{"year":2016,"cited_by_count":2},{"year":2015,"cited_by_count":5},{"year":2014,"cited_by_count":4}],"updated_date":"2026-09-22T06:50:58.402377","created_date":"2016-06-24T00:00:00"}