{"id":"https://openalex.org/W2082479751","doi":"https://doi.org/10.1016/j.rinp.2013.09.009","title":"Ferromagnetism in CdOX (X= Mn and N) with and without intrinsic point defects: A density functional theory","display_name":"Ferromagnetism in CdOX (X= Mn and N) with and without intrinsic point defects: A density functional theory","publication_year":2013,"publication_date":"2013-01-01","ids":{"openalex":"https://openalex.org/W2082479751","doi":"https://doi.org/10.1016/j.rinp.2013.09.009","mag":"2082479751"},"language":"en","primary_location":{"id":"doi:10.1016/j.rinp.2013.09.009","doi":"https://doi.org/10.1016/j.rinp.2013.09.009","is_oa":true,"landing_page_url":"https://doi.org/10.1016/j.rinp.2013.09.009","pdf_url":"https://www.sciencedirect.com/science/article/pii/S2211379713000351/pdf","source":{"id":"https://openalex.org/S2764941219","display_name":"Results in Physics","issn_l":"2211-3797","issn":["2211-3797"],"is_oa":true,"is_in_doaj":true,"is_core":true,"listed_in":["cwts-core","doaj","jufo-1","norway-1","oarl","poland-70"],"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":"cc-by-nc-nd","license_id":"https://openalex.org/licenses/cc-by-nc-nd","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Results in Physics","raw_type":"journal-article"},"volume":null,"type":"article","is_traditional":true,"indexed_in":["crossref","doaj"],"open_access":{"is_oa":true,"oa_status":"gold","oa_url":"https://www.sciencedirect.com/science/article/pii/S2211379713000351/pdf","any_repository_has_fulltext":true},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5021853495","display_name":"Z. Nabi","orcid":"https://orcid.org/0000-0001-7562-5951","observed_orcids":["https://orcid.org/0000-0001-7562-5951"]},"institutions":[{"id":"https://openalex.org/I4210125514","display_name":"Universit\u00e9 Djilali de Sidi Bel Abb\u00e8s","ror":"https://ror.org/0378szg41","country_code":"DZ","type":"education","lineage":["https://openalex.org/I4210125514"]}],"countries":["DZ"],"is_corresponding":false,"raw_author_name":"Z. Nabi","raw_affiliation_strings":["Laboratory of Catalysis and Reactive Systems, Physics Department, University of Sidi Bel Abbes, 22000, Algeria"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Laboratory of Catalysis and Reactive Systems, Physics Department, University of Sidi Bel Abbes, 22000, Algeria","institution_ids":["https://openalex.org/I4210125514"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5050294430","display_name":"S. Amari","orcid":"https://orcid.org/0000-0001-8818-7858","observed_orcids":["https://orcid.org/0000-0001-8818-7858"]},"institutions":[{"id":"https://openalex.org/I4210125514","display_name":"Universit\u00e9 Djilali de Sidi Bel Abb\u00e8s","ror":"https://ror.org/0378szg41","country_code":"DZ","type":"education","lineage":["https://openalex.org/I4210125514"]}],"countries":["DZ"],"is_corresponding":true,"raw_author_name":"S. Amari","raw_affiliation_strings":["Laboratoire de Mod\u00e9lisation et de Simulation en Sciences des Mat\u00e9riaux, D\u00e9partement de Physique, Universit\u00e9 Djillali Liab\u00e8s, Sidi Bel-Abbes, Algeria"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Laboratoire de Mod\u00e9lisation et de Simulation en Sciences des Mat\u00e9riaux, D\u00e9partement de Physique, Universit\u00e9 Djillali Liab\u00e8s, Sidi Bel-Abbes, Algeria","institution_ids":["https://openalex.org/I4210125514"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5017024810","display_name":"S. M\u00e9\u00e7abih","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I4210125514","display_name":"Universit\u00e9 Djilali de Sidi Bel Abb\u00e8s","ror":"https://ror.org/0378szg41","country_code":"DZ","type":"education","lineage":["https://openalex.org/I4210125514"]}],"countries":["DZ"],"is_corresponding":false,"raw_author_name":"S. M\u00e9\u00e7abih","raw_affiliation_strings":["Laboratoire de Mod\u00e9lisation et de Simulation en Sciences des Mat\u00e9riaux, D\u00e9partement de Physique, Universit\u00e9 Djillali Liab\u00e8s, Sidi Bel-Abbes, Algeria"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Laboratoire de Mod\u00e9lisation et de Simulation en Sciences des Mat\u00e9riaux, D\u00e9partement de Physique, Universit\u00e9 Djillali Liab\u00e8s, Sidi Bel-Abbes, Algeria","institution_ids":["https://openalex.org/I4210125514"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5088682990","display_name":"A. Zaoui","orcid":"https://orcid.org/0000-0002-8899-5545","observed_orcids":["https://orcid.org/0000-0002-8899-5545","https://orcid.org/0000-0002-5733-1199"]},"institutions":[{"id":"https://openalex.org/I4210125514","display_name":"Universit\u00e9 Djilali de Sidi Bel Abb\u00e8s","ror":"https://ror.org/0378szg41","country_code":"DZ","type":"education","lineage":["https://openalex.org/I4210125514"]}],"countries":["DZ"],"is_corresponding":false,"raw_author_name":"A. Zaoui","raw_affiliation_strings":["Laboratoire de Mod\u00e9lisation et de Simulation en Sciences des Mat\u00e9riaux, D\u00e9partement de Physique, Universit\u00e9 Djillali Liab\u00e8s, Sidi Bel-Abbes, Algeria"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Laboratoire de Mod\u00e9lisation et de Simulation en Sciences des Mat\u00e9riaux, D\u00e9partement de Physique, Universit\u00e9 Djillali Liab\u00e8s, Sidi Bel-Abbes, Algeria","institution_ids":["https://openalex.org/I4210125514"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5044784707","display_name":"Boucif Abbar","orcid":"https://orcid.org/0000-0003-2568-8668","observed_orcids":["https://orcid.org/0000-0003-2568-8668"]},"institutions":[{"id":"https://openalex.org/I4210125514","display_name":"Universit\u00e9 Djilali de Sidi Bel Abb\u00e8s","ror":"https://ror.org/0378szg41","country_code":"DZ","type":"education","lineage":["https://openalex.org/I4210125514"]}],"countries":["DZ"],"is_corresponding":false,"raw_author_name":"B. Abbar","raw_affiliation_strings":["Laboratoire de Mod\u00e9lisation et de Simulation en Sciences des Mat\u00e9riaux, D\u00e9partement de Physique, Universit\u00e9 Djillali Liab\u00e8s, Sidi Bel-Abbes, Algeria"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Laboratoire de Mod\u00e9lisation et de Simulation en Sciences des Mat\u00e9riaux, D\u00e9partement de Physique, Universit\u00e9 Djillali Liab\u00e8s, Sidi Bel-Abbes, Algeria","institution_ids":["https://openalex.org/I4210125514"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5087243705","display_name":"Bachir Bouhafs","orcid":"https://orcid.org/0000-0002-0110-9003","observed_orcids":["https://orcid.org/0000-0002-0110-9003","https://orcid.org/0000-0003-1139-2276"]},"institutions":[{"id":"https://openalex.org/I4210125514","display_name":"Universit\u00e9 Djilali de Sidi Bel Abb\u00e8s","ror":"https://ror.org/0378szg41","country_code":"DZ","type":"education","lineage":["https://openalex.org/I4210125514"]}],"countries":["DZ"],"is_corresponding":false,"raw_author_name":"B. Bouhafs","raw_affiliation_strings":["Laboratoire de Mod\u00e9lisation et de Simulation en Sciences des Mat\u00e9riaux, D\u00e9partement de Physique, Universit\u00e9 Djillali Liab\u00e8s, Sidi Bel-Abbes, Algeria"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Laboratoire de Mod\u00e9lisation et de Simulation en Sciences des Mat\u00e9riaux, D\u00e9partement de Physique, Universit\u00e9 Djillali Liab\u00e8s, Sidi Bel-Abbes, Algeria","institution_ids":["https://openalex.org/I4210125514"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5037243808","display_name":"Rajeev Ahuja","orcid":"https://orcid.org/0000-0003-1231-9994","observed_orcids":["https://orcid.org/0000-0003-1231-9994"]},"institutions":[{"id":"https://openalex.org/I123387679","display_name":"Uppsala University","ror":"https://ror.org/048a87296","country_code":"SE","type":"education","lineage":["https://openalex.org/I123387679"]}],"countries":["SE"],"is_corresponding":false,"raw_author_name":"R. Ahuja","raw_affiliation_strings":["Condensed Matter Theory Group, Department of Physics, Uppsala University, Box 530, S-751 21, Uppsala, Sweden"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Condensed Matter Theory Group, Department of Physics, Uppsala University, Box 530, S-751 21, Uppsala, Sweden","institution_ids":["https://openalex.org/I123387679"]}]}],"institutions":[],"countries_distinct_count":2,"institutions_distinct_count":2,"corresponding_author_ids":["https://openalex.org/A5050294430"],"corresponding_institution_ids":["https://openalex.org/I4210125514"],"apc_list":{"value":1920,"currency":"USD","value_usd":1920},"apc_paid":{"value":1920,"currency":"USD","value_usd":1920},"fwci":0.0,"has_fulltext":true,"cited_by_count":11,"citation_normalized_percentile":{"value":0.0,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":87,"max":96},"biblio":{"volume":"3","issue":null,"first_page":"205","last_page":"208"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10090","display_name":"ZnO doping and properties","score":0.850600004196167,"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/T10090","display_name":"ZnO doping and properties","score":0.850600004196167,"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/T12200","display_name":"Heusler alloys: electronic and magnetic properties","score":0.08320000022649765,"subfield":{"id":"https://openalex.org/subfields/2504","display_name":"Electronic, Optical and Magnetic Materials"},"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/T10607","display_name":"Magnetic and transport properties of perovskites and related materials","score":0.026900000870227814,"subfield":{"id":"https://openalex.org/subfields/2504","display_name":"Electronic, Optical and Magnetic Materials"},"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/ferromagnetism","display_name":"ferromagnetism","score":0.9049999713897705},{"id":"https://openalex.org/keywords/cdo","display_name":"CdO","score":0.7879999876022339},{"id":"https://openalex.org/keywords/mn-doping","display_name":"manganese doping","score":0.871999979019165},{"id":"https://openalex.org/keywords/nitrogen-doping","display_name":"nitrogen doping","score":0.9980000257492065},{"id":"https://openalex.org/keywords/oxygen-vacancies","display_name":"oxygen vacancies","score":0.6320000290870667},{"id":"https://openalex.org/keywords/point-defects","display_name":"point defects","score":0.8410000205039978},{"id":"https://openalex.org/keywords/antiferromagnetic-state","display_name":"antiferromagnetic phase","score":0.8240000009536743},{"id":"https://openalex.org/keywords/electronic-structure","display_name":"electronic structure","score":0.8700000047683716}],"concepts":[{"id":"https://openalex.org/C82217956","wikidata":"https://www.wikidata.org/wiki/Q184207","display_name":"Ferromagnetism","level":2,"score":0.8322449326515198},{"id":"https://openalex.org/C155355069","wikidata":"https://www.wikidata.org/wiki/Q575224","display_name":"Antiferromagnetism","level":2,"score":0.7924796342849731},{"id":"https://openalex.org/C152365726","wikidata":"https://www.wikidata.org/wiki/Q1048589","display_name":"Density functional theory","level":2,"score":0.7638065218925476},{"id":"https://openalex.org/C26873012","wikidata":"https://www.wikidata.org/wiki/Q214781","display_name":"Condensed matter physics","level":1,"score":0.7431355714797974},{"id":"https://openalex.org/C86025842","wikidata":"https://www.wikidata.org/wiki/Q5358432","display_name":"Electronic structure","level":2,"score":0.5533058643341064},{"id":"https://openalex.org/C125938697","wikidata":"https://www.wikidata.org/wiki/Q2668132","display_name":"Magnetic semiconductor","level":3,"score":0.511060357093811},{"id":"https://openalex.org/C57863236","wikidata":"https://www.wikidata.org/wiki/Q1130571","display_name":"Doping","level":2,"score":0.5014872550964355},{"id":"https://openalex.org/C192562407","wikidata":"https://www.wikidata.org/wiki/Q228736","display_name":"Materials science","level":0,"score":0.49858903884887695},{"id":"https://openalex.org/C189394030","wikidata":"https://www.wikidata.org/wiki/Q53860","display_name":"Atomic orbital","level":3,"score":0.4784436523914337},{"id":"https://openalex.org/C197162081","wikidata":"https://www.wikidata.org/wiki/Q3294789","display_name":"Magnetism","level":2,"score":0.453555166721344},{"id":"https://openalex.org/C106773901","wikidata":"https://www.wikidata.org/wiki/Q19588","display_name":"Transition metal","level":3,"score":0.45041415095329285},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.38249820470809937},{"id":"https://openalex.org/C147597530","wikidata":"https://www.wikidata.org/wiki/Q369472","display_name":"Computational chemistry","level":1,"score":0.21451494097709656},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.21338102221488953},{"id":"https://openalex.org/C62520636","wikidata":"https://www.wikidata.org/wiki/Q944","display_name":"Quantum mechanics","level":1,"score":0.08664512634277344},{"id":"https://openalex.org/C147120987","wikidata":"https://www.wikidata.org/wiki/Q2225","display_name":"Electron","level":2,"score":0.05288213491439819},{"id":"https://openalex.org/C161790260","wikidata":"https://www.wikidata.org/wiki/Q82264","display_name":"Catalysis","level":2,"score":0.0},{"id":"https://openalex.org/C55493867","wikidata":"https://www.wikidata.org/wiki/Q7094","display_name":"Biochemistry","level":1,"score":0.0}],"mesh":[],"locations_count":2,"locations":[{"id":"doi:10.1016/j.rinp.2013.09.009","doi":"https://doi.org/10.1016/j.rinp.2013.09.009","is_oa":true,"landing_page_url":"https://doi.org/10.1016/j.rinp.2013.09.009","pdf_url":"https://www.sciencedirect.com/science/article/pii/S2211379713000351/pdf","source":{"id":"https://openalex.org/S2764941219","display_name":"Results in Physics","issn_l":"2211-3797","issn":["2211-3797"],"is_oa":true,"is_in_doaj":true,"is_core":true,"listed_in":["cwts-core","doaj","jufo-1","norway-1","oarl","poland-70"],"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":"cc-by-nc-nd","license_id":"https://openalex.org/licenses/cc-by-nc-nd","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Results in Physics","raw_type":"journal-article"},{"id":"pmh:oai:DiVA.org:uu-309916","doi":null,"is_oa":true,"landing_page_url":"http://urn.kb.se/resolve?urn=urn:nbn:se:uu:diva-309916","pdf_url":null,"source":{"id":"https://openalex.org/S4306401559","display_name":"KTH Publication Database DiVA (KTH Royal Institute of Technology)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I86987016","host_organization_name":"KTH Royal Institute of Technology","host_organization_lineage":["https://openalex.org/I86987016"],"host_organization_lineage_names":[],"type":"repository"},"license":"other-oa","license_id":"https://openalex.org/licenses/other-oa","version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"","raw_type":"info:eu-repo/semantics/article"}],"best_oa_location":{"id":"doi:10.1016/j.rinp.2013.09.009","doi":"https://doi.org/10.1016/j.rinp.2013.09.009","is_oa":true,"landing_page_url":"https://doi.org/10.1016/j.rinp.2013.09.009","pdf_url":"https://www.sciencedirect.com/science/article/pii/S2211379713000351/pdf","source":{"id":"https://openalex.org/S2764941219","display_name":"Results in Physics","issn_l":"2211-3797","issn":["2211-3797"],"is_oa":true,"is_in_doaj":true,"is_core":true,"listed_in":["cwts-core","doaj","jufo-1","norway-1","oarl","poland-70"],"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":"cc-by-nc-nd","license_id":"https://openalex.org/licenses/cc-by-nc-nd","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Results in Physics","raw_type":"journal-article"},"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[],"has_content":{"grobid_xml":true,"pdf":true},"content_urls":{"pdf":"https://content.openalex.org/works/W2082479751.pdf","grobid_xml":"https://content.openalex.org/works/W2082479751.grobid-xml"},"referenced_works_count":24,"referenced_works":["https://openalex.org/W1530108315","https://openalex.org/W1564402297","https://openalex.org/W1969200114","https://openalex.org/W1979314093","https://openalex.org/W1981368803","https://openalex.org/W1988226632","https://openalex.org/W1994453650","https://openalex.org/W1998083305","https://openalex.org/W2008672714","https://openalex.org/W2016634462","https://openalex.org/W2019326057","https://openalex.org/W2024797018","https://openalex.org/W2030022862","https://openalex.org/W2037145740","https://openalex.org/W2039713211","https://openalex.org/W2043284050","https://openalex.org/W2044240130","https://openalex.org/W2075549671","https://openalex.org/W2090166310","https://openalex.org/W2090705553","https://openalex.org/W2095556621","https://openalex.org/W2099770451","https://openalex.org/W2114325825","https://openalex.org/W2118019407"],"related_works":["https://openalex.org/W2889031663","https://openalex.org/W2773426758","https://openalex.org/W2044240130","https://openalex.org/W2980720345","https://openalex.org/W2932440308","https://openalex.org/W2084747557","https://openalex.org/W4210744689","https://openalex.org/W1987797930","https://openalex.org/W653547658","https://openalex.org/W748496525"],"abstract_inverted_index":{"The":[0,27],"purpose":[1],"of":[2,9,15],"this":[3],"study":[4,63],"is":[5],"to":[6],"further":[7],"understanding":[8],"the":[10,32,43,53,60,76,90,101,110,114],"structural,":[11],"electronic,":[12],"magnetic":[13],"properties":[14],"CdO":[16,123],"doped":[17,95,118,122],"with":[18,69],"transition":[19],"metal":[20,24],"(Mn)":[21],"and":[22,70,78,81,93,98],"non":[23],"element":[25],"(N).":[26],"calculations":[28],"are":[29,87],"performed":[30,68],"by":[31],"developed":[33],"full-potential":[34],"augmented":[35],"plane":[36],"wave":[37],"plus":[38],"local":[39],"orbitals":[40],"method":[41],"within":[42],"spin":[44],"density":[45],"functional":[46],"theory.":[47],"As":[48],"exchange\u2013correlation":[49],"potential":[50],"we":[51,82,107],"used":[52],"generalized":[54],"gradient":[55],"approximation":[56],"(GGA)":[57],"form.":[58],"Moreover,":[59],"electronic":[61],"structure":[62],"for":[64],"our":[65],"compounds":[66,86],"was":[67],"without":[71],"oxygen":[72,111],"deficiency.":[73],"We":[74],"treated":[75],"ferromagnetic":[77,91],"antiferromagnetic":[79],"states":[80],"found":[83],"that":[84,109],"all":[85,94],"stable":[88],"in":[89,116],"structure,":[92],"materials":[96],"CdO:Mn":[97],"CdO:N":[99],"adopt":[100],"half":[102],"metallic":[103],"character.":[104],"In":[105],"addition,":[106],"notice":[108],"vacancy":[112],"destroyed":[113],"ferromagnetism":[115],"N":[117],"CdO,":[119],"while":[120],"Mn":[121],"becomes":[124],"semiconductor.":[125]},"counts_by_year":[{"year":2024,"cited_by_count":2},{"year":2022,"cited_by_count":3},{"year":2021,"cited_by_count":1},{"year":2019,"cited_by_count":1},{"year":2018,"cited_by_count":2},{"year":2017,"cited_by_count":2}],"updated_date":"2026-10-30T12:39:25.321706","created_date":"2016-06-24T00:00:00"}