{"id":"https://openalex.org/W2000583575","doi":"https://doi.org/10.1016/j.solidstatesciences.2014.07.014","title":"A DFT study on structural stability and electronic property of VIIIB transition metal-doped carbon nanocaps","display_name":"A DFT study on structural stability and electronic property of VIIIB transition metal-doped carbon nanocaps","publication_year":2014,"publication_date":"2014-08-19","ids":{"openalex":"https://openalex.org/W2000583575","doi":"https://doi.org/10.1016/j.solidstatesciences.2014.07.014","mag":"2000583575"},"language":"en","primary_location":{"id":"doi:10.1016/j.solidstatesciences.2014.07.014","doi":"https://doi.org/10.1016/j.solidstatesciences.2014.07.014","is_oa":false,"landing_page_url":"https://doi.org/10.1016/j.solidstatesciences.2014.07.014","pdf_url":null,"source":{"id":"https://openalex.org/S40206742","display_name":"Solid State Sciences","issn_l":"1293-2558","issn":["1293-2558","1873-3085"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["anvur-scientific","cwts-core","dongbi-c","jufo-1","norway-1","poland-70","russia-white-list-1"],"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":"Solid State Sciences","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/A5031472782","display_name":"Chanukorn Tabtimsai","orcid":"https://orcid.org/0000-0002-3633-3435","observed_orcids":["https://orcid.org/0000-0002-3633-3435"]},"institutions":[{"id":"https://openalex.org/I4210135781","display_name":"Rajabhat Maha Sarakham University","ror":"https://ror.org/03n273w86","country_code":"TH","type":"education","lineage":["https://openalex.org/I4210135781"]}],"countries":["TH"],"is_corresponding":false,"raw_author_name":"Chanukorn Tabtimsai","raw_affiliation_strings":["Computational Chemistry Center for Nanotechnology and Department of Chemistry, Faculty of Science and Technology, Rajabhat Maha Sarakham University, Maha Sarakham 44000, Thailand"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Computational Chemistry Center for Nanotechnology and Department of Chemistry, Faculty of Science and Technology, Rajabhat Maha Sarakham University, Maha Sarakham 44000, Thailand","institution_ids":["https://openalex.org/I4210135781"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5038162601","display_name":"Sarawut Tontapha","orcid":"https://orcid.org/0000-0002-8648-2375","observed_orcids":["https://orcid.org/0000-0002-8648-2375"]},"institutions":[{"id":"https://openalex.org/I123096312","display_name":"Mahasarakham University","ror":"https://ror.org/0453j3c58","country_code":"TH","type":"education","lineage":["https://openalex.org/I123096312"]}],"countries":["TH"],"is_corresponding":false,"raw_author_name":"Sarawut Tontapha","raw_affiliation_strings":["Center of Excellence for Innovation in Chemistry and Supramolecular Chemistry Research Unit, Department of Chemistry, Faculty of Science, Mahasarakham University, Maha Sarakham 44150, Thailand"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Center of Excellence for Innovation in Chemistry and Supramolecular Chemistry Research Unit, Department of Chemistry, Faculty of Science, Mahasarakham University, Maha Sarakham 44150, Thailand","institution_ids":["https://openalex.org/I123096312"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5081086043","display_name":"Wandee Rakrai","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I4210135781","display_name":"Rajabhat Maha Sarakham University","ror":"https://ror.org/03n273w86","country_code":"TH","type":"education","lineage":["https://openalex.org/I4210135781"]}],"countries":["TH"],"is_corresponding":false,"raw_author_name":"Wandee Rakrai","raw_affiliation_strings":["Computational Chemistry Center for Nanotechnology and Department of Chemistry, Faculty of Science and Technology, Rajabhat Maha Sarakham University, Maha Sarakham 44000, Thailand"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Computational Chemistry Center for Nanotechnology and Department of Chemistry, Faculty of Science and Technology, Rajabhat Maha Sarakham University, Maha Sarakham 44000, Thailand","institution_ids":["https://openalex.org/I4210135781"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5038050506","display_name":"Banchob Wanno","orcid":"https://orcid.org/0000-0001-7908-7652","observed_orcids":["https://orcid.org/0000-0001-7908-7652"]},"institutions":[{"id":"https://openalex.org/I123096312","display_name":"Mahasarakham University","ror":"https://ror.org/0453j3c58","country_code":"TH","type":"education","lineage":["https://openalex.org/I123096312"]}],"countries":["TH"],"is_corresponding":true,"raw_author_name":"Banchob Wanno","raw_affiliation_strings":["Center of Excellence for Innovation in Chemistry and Supramolecular Chemistry Research Unit, Department of Chemistry, Faculty of Science, Mahasarakham University, Maha Sarakham 44150, Thailand"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Center of Excellence for Innovation in Chemistry and Supramolecular Chemistry Research Unit, Department of Chemistry, Faculty of Science, Mahasarakham University, Maha Sarakham 44150, Thailand","institution_ids":["https://openalex.org/I123096312"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":2,"corresponding_author_ids":["https://openalex.org/A5038050506"],"corresponding_institution_ids":["https://openalex.org/I123096312"],"apc_list":{"value":3070,"currency":"USD","value_usd":3070},"apc_paid":null,"fwci":0.1347,"has_fulltext":false,"cited_by_count":8,"citation_normalized_percentile":{"value":0.44060384,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":88,"max":95},"biblio":{"volume":"37","issue":null,"first_page":"6","last_page":"12"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T11341","display_name":"Boron and Carbon Nanomaterials Research","score":0.7035999894142151,"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"}},"topics":[{"id":"https://openalex.org/T11341","display_name":"Boron and Carbon Nanomaterials Research","score":0.7035999894142151,"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/T10956","display_name":"Fullerene Chemistry and Applications","score":0.08100000023841858,"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/T10083","display_name":"Graphene research and applications","score":0.07289999723434448,"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/transition-metal-doping","display_name":"transition metal doping","score":0.8600000143051147},{"id":"https://openalex.org/keywords/structural-stability","display_name":"structural stability","score":0.8899999856948853},{"id":"https://openalex.org/keywords/electronic-properties","display_name":"electronic properties","score":0.9639999866485596},{"id":"https://openalex.org/keywords/charge-transfer","display_name":"charge transfer","score":0.7940000295639038},{"id":"https://openalex.org/keywords/density-of-states","display_name":"density of states","score":0.7310000061988831},{"id":"https://openalex.org/keywords/metallic-and-semiconducting-behavior","display_name":"metallic and semiconducting behavior","score":0.6340000033378601},{"id":"https://openalex.org/keywords/molecular-orbitals","display_name":"molecular orbitals","score":0.7390000224113464}],"concepts":[{"id":"https://openalex.org/C57863236","wikidata":"https://www.wikidata.org/wiki/Q1130571","display_name":"Doping","level":2,"score":0.7737789154052734},{"id":"https://openalex.org/C192562407","wikidata":"https://www.wikidata.org/wiki/Q228736","display_name":"Materials science","level":0,"score":0.6672895550727844},{"id":"https://openalex.org/C152365726","wikidata":"https://www.wikidata.org/wiki/Q1048589","display_name":"Density functional theory","level":2,"score":0.6467788219451904},{"id":"https://openalex.org/C106773901","wikidata":"https://www.wikidata.org/wiki/Q19588","display_name":"Transition metal","level":3,"score":0.629368245601654},{"id":"https://openalex.org/C189394030","wikidata":"https://www.wikidata.org/wiki/Q53860","display_name":"Atomic orbital","level":3,"score":0.571785032749176},{"id":"https://openalex.org/C140205800","wikidata":"https://www.wikidata.org/wiki/Q5860","display_name":"Carbon fibers","level":3,"score":0.555508017539978},{"id":"https://openalex.org/C86025842","wikidata":"https://www.wikidata.org/wiki/Q5358432","display_name":"Electronic structure","level":2,"score":0.4933735430240631},{"id":"https://openalex.org/C544153396","wikidata":"https://www.wikidata.org/wiki/Q11426","display_name":"Metal","level":2,"score":0.48001188039779663},{"id":"https://openalex.org/C108225325","wikidata":"https://www.wikidata.org/wiki/Q11456","display_name":"Semiconductor","level":2,"score":0.4672088027000427},{"id":"https://openalex.org/C159467904","wikidata":"https://www.wikidata.org/wiki/Q2001702","display_name":"Chemical physics","level":1,"score":0.36347609758377075},{"id":"https://openalex.org/C8010536","wikidata":"https://www.wikidata.org/wiki/Q160398","display_name":"Crystallography","level":1,"score":0.3625441789627075},{"id":"https://openalex.org/C147597530","wikidata":"https://www.wikidata.org/wiki/Q369472","display_name":"Computational chemistry","level":1,"score":0.35655999183654785},{"id":"https://openalex.org/C171250308","wikidata":"https://www.wikidata.org/wiki/Q11468","display_name":"Nanotechnology","level":1,"score":0.32852903008461},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.27530816197395325},{"id":"https://openalex.org/C49040817","wikidata":"https://www.wikidata.org/wiki/Q193091","display_name":"Optoelectronics","level":1,"score":0.14016523957252502},{"id":"https://openalex.org/C147120987","wikidata":"https://www.wikidata.org/wiki/Q2225","display_name":"Electron","level":2,"score":0.06496739387512207},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.06394138932228088},{"id":"https://openalex.org/C191897082","wikidata":"https://www.wikidata.org/wiki/Q11467","display_name":"Metallurgy","level":1,"score":0.06326395273208618},{"id":"https://openalex.org/C159985019","wikidata":"https://www.wikidata.org/wiki/Q181790","display_name":"Composite material","level":1,"score":0.06304901838302612},{"id":"https://openalex.org/C161790260","wikidata":"https://www.wikidata.org/wiki/Q82264","display_name":"Catalysis","level":2,"score":0.06037724018096924},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.052234381437301636},{"id":"https://openalex.org/C104779481","wikidata":"https://www.wikidata.org/wiki/Q50707","display_name":"Composite number","level":2,"score":0.0},{"id":"https://openalex.org/C62520636","wikidata":"https://www.wikidata.org/wiki/Q944","display_name":"Quantum mechanics","level":1,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1016/j.solidstatesciences.2014.07.014","doi":"https://doi.org/10.1016/j.solidstatesciences.2014.07.014","is_oa":false,"landing_page_url":"https://doi.org/10.1016/j.solidstatesciences.2014.07.014","pdf_url":null,"source":{"id":"https://openalex.org/S40206742","display_name":"Solid State Sciences","issn_l":"1293-2558","issn":["1293-2558","1873-3085"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["anvur-scientific","cwts-core","dongbi-c","jufo-1","norway-1","poland-70","russia-white-list-1"],"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":"Solid State Sciences","raw_type":"journal-article"}],"best_oa_location":null,"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[{"id":"https://openalex.org/F4320318333","display_name":"Rajabhat Maha Sarakham University","ror":"https://ror.org/03n273w86"},{"id":"https://openalex.org/F4320324290","display_name":"Mahasarakham University","ror":"https://ror.org/0453j3c58"}],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":44,"referenced_works":["https://openalex.org/W1513301399","https://openalex.org/W1966182479","https://openalex.org/W1967336441","https://openalex.org/W1968374638","https://openalex.org/W1975841317","https://openalex.org/W1987773763","https://openalex.org/W1989911071","https://openalex.org/W1993543602","https://openalex.org/W1994333646","https://openalex.org/W1997436616","https://openalex.org/W1999329025","https://openalex.org/W2001575610","https://openalex.org/W2004561253","https://openalex.org/W2005877813","https://openalex.org/W2018858346","https://openalex.org/W2023271753","https://openalex.org/W2023966886","https://openalex.org/W2026336282","https://openalex.org/W2027201694","https://openalex.org/W2031944468","https://openalex.org/W2033884896","https://openalex.org/W2044202126","https://openalex.org/W2044490585","https://openalex.org/W2045479894","https://openalex.org/W2050476929","https://openalex.org/W2055085135","https://openalex.org/W2055608717","https://openalex.org/W2067058956","https://openalex.org/W2068617439","https://openalex.org/W2071096669","https://openalex.org/W2071709099","https://openalex.org/W2076483320","https://openalex.org/W2079163836","https://openalex.org/W2081955428","https://openalex.org/W2082653076","https://openalex.org/W2100488196","https://openalex.org/W2102709102","https://openalex.org/W2106824077","https://openalex.org/W2152199549","https://openalex.org/W2316652361","https://openalex.org/W2329717581","https://openalex.org/W4206414219","https://openalex.org/W4285719527","https://openalex.org/W4388227728"],"related_works":["https://openalex.org/W2329434287","https://openalex.org/W4200342905","https://openalex.org/W2316652361","https://openalex.org/W2027534003","https://openalex.org/W2002489611","https://openalex.org/W4414981566","https://openalex.org/W1546529040","https://openalex.org/W2324390081","https://openalex.org/W4405500350","https://openalex.org/W2023257487"],"abstract_inverted_index":null,"counts_by_year":[{"year":2025,"cited_by_count":1},{"year":2023,"cited_by_count":1},{"year":2022,"cited_by_count":2},{"year":2021,"cited_by_count":2},{"year":2018,"cited_by_count":1},{"year":2017,"cited_by_count":1}],"updated_date":"2026-10-30T12:39:25.321706","created_date":"2016-06-24T00:00:00"}