{"id":"https://openalex.org/W3201408200","doi":"https://doi.org/10.1007/978-3-030-87016-4_31","title":"Long-Range Complex in the HC$$_{3}$$N + CN Potential Energy Surface: Ab Initio Calculations and Intermolecular Potential","display_name":"Long-Range Complex in the HC$$_{3}$$N + CN Potential Energy Surface: Ab Initio Calculations and Intermolecular Potential","publication_year":2021,"publication_date":"2021-01-01","ids":{"openalex":"https://openalex.org/W3201408200","doi":"https://doi.org/10.1007/978-3-030-87016-4_31","mag":"3201408200"},"language":"en","primary_location":{"id":"doi:10.1007/978-3-030-87016-4_31","is_oa":false,"landing_page_url":"https://doi.org/10.1007/978-3-030-87016-4_31","pdf_url":null,"source":{"id":"https://openalex.org/S106296714","display_name":"Lecture notes in computer science","issn_l":"0302-9743","issn":["0302-9743","1611-3349"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310319900","host_organization_name":"Springer Science+Business Media","host_organization_lineage":["https://openalex.org/P4310319900","https://openalex.org/P4310319965"],"host_organization_lineage_names":["Springer Science+Business Media","Springer Nature"],"type":"book series"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Lecture Notes in Computer Science","raw_type":"book-chapter"},"type":"book-chapter","indexed_in":["arxiv","crossref"],"open_access":{"is_oa":true,"oa_status":"green","oa_url":"https://arxiv.org/pdf/2212.11312","any_repository_has_fulltext":true},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5049550165","display_name":"Em\u00edlia Valen\u00e7a Ferreira de Arag\u00e3o","orcid":"https://orcid.org/0000-0002-8067-0914"},"institutions":[{"id":"https://openalex.org/I27483092","display_name":"University of Perugia","ror":"https://ror.org/00x27da85","country_code":"IT","type":"education","lineage":["https://openalex.org/I27483092"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Em\u00edlia Valen\u00e7a Ferreira de Arag\u00e3o","raw_affiliation_strings":["Dipartimento di Chimica, Biologia e Biotecnologie, Universit\u00e0 degli Studi di Perugia, Perugia, Italy","Master-tec srl, Perugia, Italy"],"raw_orcid":"https://orcid.org/0000-0002-8067-0914","affiliations":[{"raw_affiliation_string":"Dipartimento di Chimica, Biologia e Biotecnologie, Universit\u00e0 degli Studi di Perugia, Perugia, Italy","institution_ids":["https://openalex.org/I27483092"]},{"raw_affiliation_string":"Master-tec srl, Perugia, Italy","institution_ids":[]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5082991374","display_name":"Luca Mancini","orcid":"https://orcid.org/0000-0002-9754-6071"},"institutions":[{"id":"https://openalex.org/I27483092","display_name":"University of Perugia","ror":"https://ror.org/00x27da85","country_code":"IT","type":"education","lineage":["https://openalex.org/I27483092"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Luca Mancini","raw_affiliation_strings":["Dipartimento di Chimica, Biologia e Biotecnologie, Universit\u00e0 degli Studi di Perugia, Perugia, Italy"],"raw_orcid":"https://orcid.org/0000-0002-9754-6071","affiliations":[{"raw_affiliation_string":"Dipartimento di Chimica, Biologia e Biotecnologie, Universit\u00e0 degli Studi di Perugia, Perugia, Italy","institution_ids":["https://openalex.org/I27483092"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5070740378","display_name":"Noelia Faginas\u2010Lago","orcid":"https://orcid.org/0000-0002-4056-3364"},"institutions":[{"id":"https://openalex.org/I27483092","display_name":"University of Perugia","ror":"https://ror.org/00x27da85","country_code":"IT","type":"education","lineage":["https://openalex.org/I27483092"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Noelia Faginas-Lago","raw_affiliation_strings":["Dipartimento di Chimica, Biologia e Biotecnologie, Universit\u00e0 degli Studi di Perugia, Perugia, Italy"],"raw_orcid":"https://orcid.org/0000-0002-4056-3364","affiliations":[{"raw_affiliation_string":"Dipartimento di Chimica, Biologia e Biotecnologie, Universit\u00e0 degli Studi di Perugia, Perugia, Italy","institution_ids":["https://openalex.org/I27483092"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5071062839","display_name":"Marzio Rosi","orcid":"https://orcid.org/0000-0002-1264-3877"},"institutions":[{"id":"https://openalex.org/I27483092","display_name":"University of Perugia","ror":"https://ror.org/00x27da85","country_code":"IT","type":"education","lineage":["https://openalex.org/I27483092"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Marzio Rosi","raw_affiliation_strings":["Dipartimento di Ingegneria Civile ed Ambientale, Universit\u00e0 degli Studi di Perugia, Perugia, Italy"],"raw_orcid":"https://orcid.org/0000-0002-1264-3877","affiliations":[{"raw_affiliation_string":"Dipartimento di Ingegneria Civile ed Ambientale, Universit\u00e0 degli Studi di Perugia, Perugia, Italy","institution_ids":["https://openalex.org/I27483092"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5038953056","display_name":"Nadia Balucani","orcid":"https://orcid.org/0000-0001-5121-5683"},"institutions":[{"id":"https://openalex.org/I27483092","display_name":"University of Perugia","ror":"https://ror.org/00x27da85","country_code":"IT","type":"education","lineage":["https://openalex.org/I27483092"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Nadia Balucani","raw_affiliation_strings":["Dipartimento di Chimica, Biologia e Biotecnologie, Universit\u00e0 degli Studi di Perugia, Perugia, Italy"],"raw_orcid":"https://orcid.org/0000-0001-5121-5683","affiliations":[{"raw_affiliation_string":"Dipartimento di Chimica, Biologia e Biotecnologie, Universit\u00e0 degli Studi di Perugia, Perugia, Italy","institution_ids":["https://openalex.org/I27483092"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5075821338","display_name":"Fernando Pirani","orcid":"https://orcid.org/0000-0003-3110-6521"},"institutions":[{"id":"https://openalex.org/I27483092","display_name":"University of Perugia","ror":"https://ror.org/00x27da85","country_code":"IT","type":"education","lineage":["https://openalex.org/I27483092"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Fernando Pirani","raw_affiliation_strings":["Dipartimento di Chimica, Biologia e Biotecnologie, Universit\u00e0 degli Studi di Perugia, Perugia, Italy"],"raw_orcid":"https://orcid.org/0000-0003-3110-6521","affiliations":[{"raw_affiliation_string":"Dipartimento di Chimica, Biologia e Biotecnologie, Universit\u00e0 degli Studi di Perugia, Perugia, Italy","institution_ids":["https://openalex.org/I27483092"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":1,"corresponding_author_ids":[],"corresponding_institution_ids":["https://openalex.org/I27483092"],"apc_list":{"value":5000,"currency":"EUR","value_usd":5392},"apc_paid":null,"fwci":3.675,"has_fulltext":false,"cited_by_count":2,"citation_normalized_percentile":{"value":0.92623405,"is_in_top_1_percent":false,"is_in_top_10_percent":true},"cited_by_percentile_year":{"min":94,"max":96},"biblio":{"volume":null,"issue":null,"first_page":"413","last_page":"425"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10002","display_name":"Advanced Chemical Physics Studies","score":0.9988999962806702,"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":0.9988999962806702,"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/T10477","display_name":"Astrophysics and Star Formation Studies","score":0.9976000189781189,"subfield":{"id":"https://openalex.org/subfields/3103","display_name":"Astronomy and Astrophysics"},"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/T11965","display_name":"Quantum, superfluid, helium dynamics","score":0.9972000122070312,"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"}}],"keywords":[{"id":"https://openalex.org/keywords/ab-initio","display_name":"Ab initio","score":0.8020453453063965},{"id":"https://openalex.org/keywords/van-der-waals-force","display_name":"van der Waals force","score":0.7410645484924316},{"id":"https://openalex.org/keywords/intermolecular-force","display_name":"Intermolecular force","score":0.7400892376899719},{"id":"https://openalex.org/keywords/adduct","display_name":"Adduct","score":0.7396755218505859},{"id":"https://openalex.org/keywords/chemistry","display_name":"Chemistry","score":0.6436567902565002},{"id":"https://openalex.org/keywords/potential-energy-surface","display_name":"Potential energy surface","score":0.6422970294952393},{"id":"https://openalex.org/keywords/saddle-point","display_name":"Saddle point","score":0.6292865872383118},{"id":"https://openalex.org/keywords/ab-initio-quantum-chemistry-methods","display_name":"Ab initio quantum chemistry methods","score":0.5874899625778198},{"id":"https://openalex.org/keywords/computational-chemistry","display_name":"Computational chemistry","score":0.530437707901001},{"id":"https://openalex.org/keywords/molecule","display_name":"Molecule","score":0.1806907057762146},{"id":"https://openalex.org/keywords/organic-chemistry","display_name":"Organic chemistry","score":0.07262730598449707},{"id":"https://openalex.org/keywords/geometry","display_name":"Geometry","score":0.06786167621612549}],"concepts":[{"id":"https://openalex.org/C2781442258","wikidata":"https://www.wikidata.org/wiki/Q46310","display_name":"Ab initio","level":2,"score":0.8020453453063965},{"id":"https://openalex.org/C126061179","wikidata":"https://www.wikidata.org/wiki/Q189627","display_name":"van der Waals force","level":3,"score":0.7410645484924316},{"id":"https://openalex.org/C166950319","wikidata":"https://www.wikidata.org/wiki/Q245031","display_name":"Intermolecular force","level":3,"score":0.7400892376899719},{"id":"https://openalex.org/C108204754","wikidata":"https://www.wikidata.org/wiki/Q353392","display_name":"Adduct","level":2,"score":0.7396755218505859},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.6436567902565002},{"id":"https://openalex.org/C125277925","wikidata":"https://www.wikidata.org/wiki/Q2572687","display_name":"Potential energy surface","level":3,"score":0.6422970294952393},{"id":"https://openalex.org/C2681867","wikidata":"https://www.wikidata.org/wiki/Q690935","display_name":"Saddle point","level":2,"score":0.6292865872383118},{"id":"https://openalex.org/C183971685","wikidata":"https://www.wikidata.org/wiki/Q547605","display_name":"Ab initio quantum chemistry methods","level":3,"score":0.5874899625778198},{"id":"https://openalex.org/C147597530","wikidata":"https://www.wikidata.org/wiki/Q369472","display_name":"Computational chemistry","level":1,"score":0.530437707901001},{"id":"https://openalex.org/C32909587","wikidata":"https://www.wikidata.org/wiki/Q11369","display_name":"Molecule","level":2,"score":0.1806907057762146},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.07262730598449707},{"id":"https://openalex.org/C2524010","wikidata":"https://www.wikidata.org/wiki/Q8087","display_name":"Geometry","level":1,"score":0.06786167621612549},{"id":"https://openalex.org/C33923547","wikidata":"https://www.wikidata.org/wiki/Q395","display_name":"Mathematics","level":0,"score":0.0}],"mesh":[],"locations_count":2,"locations":[{"id":"doi:10.1007/978-3-030-87016-4_31","is_oa":false,"landing_page_url":"https://doi.org/10.1007/978-3-030-87016-4_31","pdf_url":null,"source":{"id":"https://openalex.org/S106296714","display_name":"Lecture notes in computer science","issn_l":"0302-9743","issn":["0302-9743","1611-3349"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310319900","host_organization_name":"Springer Science+Business Media","host_organization_lineage":["https://openalex.org/P4310319900","https://openalex.org/P4310319965"],"host_organization_lineage_names":["Springer Science+Business Media","Springer Nature"],"type":"book series"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Lecture Notes in Computer Science","raw_type":"book-chapter"},{"id":"pmh:oai:arXiv.org:2212.11312","is_oa":true,"landing_page_url":"http://arxiv.org/abs/2212.11312","pdf_url":"https://arxiv.org/pdf/2212.11312","source":{"id":"https://openalex.org/S4306400194","display_name":"arXiv (Cornell University)","issn_l":null,"issn":null,"is_oa":true,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I205783295","host_organization_name":"Cornell University","host_organization_lineage":["https://openalex.org/I205783295"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":null,"raw_type":"text"}],"best_oa_location":{"id":"pmh:oai:arXiv.org:2212.11312","is_oa":true,"landing_page_url":"http://arxiv.org/abs/2212.11312","pdf_url":"https://arxiv.org/pdf/2212.11312","source":{"id":"https://openalex.org/S4306400194","display_name":"arXiv (Cornell University)","issn_l":null,"issn":null,"is_oa":true,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I205783295","host_organization_name":"Cornell University","host_organization_lineage":["https://openalex.org/I205783295"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":null,"raw_type":"text"},"sustainable_development_goals":[{"id":"https://metadata.un.org/sdg/7","score":0.8899999856948853,"display_name":"Affordable and clean energy"}],"awards":[],"funders":[],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":49,"referenced_works":["https://openalex.org/W159947417","https://openalex.org/W1633999093","https://openalex.org/W1810486967","https://openalex.org/W1967811999","https://openalex.org/W2013872153","https://openalex.org/W2014767176","https://openalex.org/W2020227198","https://openalex.org/W2020376112","https://openalex.org/W2022819150","https://openalex.org/W2023232960","https://openalex.org/W2028046413","https://openalex.org/W2033155038","https://openalex.org/W2034059330","https://openalex.org/W2034813140","https://openalex.org/W2036796261","https://openalex.org/W2044574194","https://openalex.org/W2064214430","https://openalex.org/W2069006374","https://openalex.org/W2079458939","https://openalex.org/W2080245341","https://openalex.org/W2083940276","https://openalex.org/W2089369181","https://openalex.org/W2092930273","https://openalex.org/W2101263707","https://openalex.org/W2130264785","https://openalex.org/W2135257326","https://openalex.org/W2143981217","https://openalex.org/W2148284063","https://openalex.org/W2177252302","https://openalex.org/W2322344722","https://openalex.org/W2527981863","https://openalex.org/W2615934158","https://openalex.org/W2762117605","https://openalex.org/W2765267165","https://openalex.org/W2783422135","https://openalex.org/W2783991809","https://openalex.org/W2790033221","https://openalex.org/W2893863737","https://openalex.org/W2896845116","https://openalex.org/W2950396846","https://openalex.org/W2993632117","https://openalex.org/W3091339710","https://openalex.org/W3092830208","https://openalex.org/W3099492372","https://openalex.org/W3104001772","https://openalex.org/W3104429163","https://openalex.org/W3120999072","https://openalex.org/W3123260441","https://openalex.org/W3202122942"],"related_works":["https://openalex.org/W2036365018","https://openalex.org/W2319832848","https://openalex.org/W2324822375","https://openalex.org/W2248924491","https://openalex.org/W2006550696","https://openalex.org/W2790897367","https://openalex.org/W2081567253","https://openalex.org/W2066084917","https://openalex.org/W2058033289","https://openalex.org/W2088297177"],"abstract_inverted_index":null,"counts_by_year":[{"year":2023,"cited_by_count":2}],"updated_date":"2026-07-03T08:13:44.112507","created_date":"2021-09-27T00:00:00"}
