{"id":"https://openalex.org/W1996043575","doi":"https://doi.org/10.1016/j.cattod.2010.10.011","title":"Surface reduction processes of cerium oxide surfaces by H2 using ultra accelerated quantum chemical molecular dynamic study","display_name":"Surface reduction processes of cerium oxide surfaces by H2 using ultra accelerated quantum chemical molecular dynamic study","publication_year":2010,"publication_date":"2010-11-05","ids":{"openalex":"https://openalex.org/W1996043575","doi":"https://doi.org/10.1016/j.cattod.2010.10.011","mag":"1996043575"},"language":"en","primary_location":{"id":"doi:10.1016/j.cattod.2010.10.011","doi":"https://doi.org/10.1016/j.cattod.2010.10.011","is_oa":false,"landing_page_url":"https://doi.org/10.1016/j.cattod.2010.10.011","pdf_url":null,"source":{"id":"https://openalex.org/S117279562","display_name":"Catalysis Today","issn_l":"0920-5861","issn":["0920-5861","1873-4308"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["anvur-scientific","cwts-core","dongbi-b","jufo-1","norway-2","poland-140","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":"Catalysis Today","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/A5074056624","display_name":"Md. Korshed Alam","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I201537933","display_name":"Tohoku University","ror":"https://ror.org/01dq60k83","country_code":"JP","type":"education","lineage":["https://openalex.org/I201537933"]}],"countries":["JP"],"is_corresponding":false,"raw_author_name":"Md. Korshed Alam","raw_affiliation_strings":["Department of Chemical Engineering, Graduate School of Engineering, Tohoku University, 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai, 980-8579, Japan"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemical Engineering, Graduate School of Engineering, Tohoku University, 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai, 980-8579, Japan","institution_ids":["https://openalex.org/I201537933"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5102082764","display_name":"Farouq Ahmed","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I201537933","display_name":"Tohoku University","ror":"https://ror.org/01dq60k83","country_code":"JP","type":"education","lineage":["https://openalex.org/I201537933"]}],"countries":["JP"],"is_corresponding":false,"raw_author_name":"Farouq Ahmed","raw_affiliation_strings":["Department of Applied Chemistry, Graduate School of Engineering, Tohoku University, 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai, 980-8579, Japan"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Applied Chemistry, Graduate School of Engineering, Tohoku University, 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai, 980-8579, Japan","institution_ids":["https://openalex.org/I201537933"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5008864206","display_name":"Ryuji Miura","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I201537933","display_name":"Tohoku University","ror":"https://ror.org/01dq60k83","country_code":"JP","type":"education","lineage":["https://openalex.org/I201537933"]}],"countries":["JP"],"is_corresponding":false,"raw_author_name":"Ryuji Miura","raw_affiliation_strings":["Department of Applied Chemistry, Graduate School of Engineering, Tohoku University, 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai, 980-8579, Japan"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Applied Chemistry, Graduate School of Engineering, Tohoku University, 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai, 980-8579, Japan","institution_ids":["https://openalex.org/I201537933"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5101653504","display_name":"Ai Suzuki","orcid":"https://orcid.org/0000-0003-2527-2785","observed_orcids":["https://orcid.org/0000-0003-2527-2785"]},"institutions":[{"id":"https://openalex.org/I201537933","display_name":"Tohoku University","ror":"https://ror.org/01dq60k83","country_code":"JP","type":"education","lineage":["https://openalex.org/I201537933"]},{"id":"https://openalex.org/I4405287282","display_name":"New Industry Creation Hatchery Center, Tohoku University","ror":"https://ror.org/04ps06597","country_code":"JP","type":"facility","lineage":["https://openalex.org/I201537933","https://openalex.org/I4405287282"]}],"countries":["JP"],"is_corresponding":false,"raw_author_name":"Ai Suzuki","raw_affiliation_strings":["New Industry Creation Hatchery Center, Tohoku University, 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai 980-8579, Japan"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"New Industry Creation Hatchery Center, Tohoku University, 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai 980-8579, Japan","institution_ids":["https://openalex.org/I201537933","https://openalex.org/I4405287282"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5112259340","display_name":"Hideyuki Tsuboi","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I201537933","display_name":"Tohoku University","ror":"https://ror.org/01dq60k83","country_code":"JP","type":"education","lineage":["https://openalex.org/I201537933"]}],"countries":["JP"],"is_corresponding":false,"raw_author_name":"Hideyuki Tsuboi","raw_affiliation_strings":["Department of Applied Chemistry, Graduate School of Engineering, Tohoku University, 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai, 980-8579, Japan"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Applied Chemistry, Graduate School of Engineering, Tohoku University, 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai, 980-8579, Japan","institution_ids":["https://openalex.org/I201537933"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5113902290","display_name":"Nozomu Hatakeyama","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I201537933","display_name":"Tohoku University","ror":"https://ror.org/01dq60k83","country_code":"JP","type":"education","lineage":["https://openalex.org/I201537933"]}],"countries":["JP"],"is_corresponding":false,"raw_author_name":"Nozomu Hatakeyama","raw_affiliation_strings":["Department of Applied Chemistry, Graduate School of Engineering, Tohoku University, 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai, 980-8579, Japan"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Applied Chemistry, Graduate School of Engineering, Tohoku University, 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai, 980-8579, Japan","institution_ids":["https://openalex.org/I201537933"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5111379368","display_name":"Akira Endou","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I201537933","display_name":"Tohoku University","ror":"https://ror.org/01dq60k83","country_code":"JP","type":"education","lineage":["https://openalex.org/I201537933"]}],"countries":["JP"],"is_corresponding":false,"raw_author_name":"Akira Endou","raw_affiliation_strings":["Department of Applied Chemistry, Graduate School of Engineering, Tohoku University, 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai, 980-8579, Japan"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Applied Chemistry, Graduate School of Engineering, Tohoku University, 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai, 980-8579, Japan","institution_ids":["https://openalex.org/I201537933"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5026195965","display_name":"Hiromitsu Takaba","orcid":"https://orcid.org/0000-0003-1622-5485","observed_orcids":["https://orcid.org/0000-0003-1622-5485"]},"institutions":[{"id":"https://openalex.org/I201537933","display_name":"Tohoku University","ror":"https://ror.org/01dq60k83","country_code":"JP","type":"education","lineage":["https://openalex.org/I201537933"]}],"countries":["JP"],"is_corresponding":false,"raw_author_name":"Hiromitsu Takaba","raw_affiliation_strings":["Department of Chemical Engineering, Graduate School of Engineering, Tohoku University, 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai, 980-8579, Japan"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemical Engineering, Graduate School of Engineering, Tohoku University, 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai, 980-8579, Japan","institution_ids":["https://openalex.org/I201537933"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5079425945","display_name":"Momoji Kubo","orcid":"https://orcid.org/0000-0002-3310-1858","observed_orcids":["https://orcid.org/0000-0002-3310-1858"]},"institutions":[{"id":"https://openalex.org/I201537933","display_name":"Tohoku University","ror":"https://ror.org/01dq60k83","country_code":"JP","type":"education","lineage":["https://openalex.org/I201537933"]},{"id":"https://openalex.org/I4405285875","display_name":"Fracture and Reliability Research Institute","ror":"https://ror.org/00jtsrp93","country_code":"JP","type":"facility","lineage":["https://openalex.org/I201537933","https://openalex.org/I4405285875"]}],"countries":["JP"],"is_corresponding":false,"raw_author_name":"Momoji Kubo","raw_affiliation_strings":["Fracture and Reliability Research Institute, Graduate School of Engineering, Tohoku University, 6-6-11-701 Aoba, Sendai 980-8579, Japan"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Fracture and Reliability Research Institute, Graduate School of Engineering, Tohoku University, 6-6-11-701 Aoba, Sendai 980-8579, Japan","institution_ids":["https://openalex.org/I201537933","https://openalex.org/I4405285875"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5110733671","display_name":"Akira Miyamoto","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I201537933","display_name":"Tohoku University","ror":"https://ror.org/01dq60k83","country_code":"JP","type":"education","lineage":["https://openalex.org/I201537933"]},{"id":"https://openalex.org/I4405287282","display_name":"New Industry Creation Hatchery Center, Tohoku University","ror":"https://ror.org/04ps06597","country_code":"JP","type":"facility","lineage":["https://openalex.org/I201537933","https://openalex.org/I4405287282"]}],"countries":["JP"],"is_corresponding":false,"raw_author_name":"Akira Miyamoto","raw_affiliation_strings":["New Industry Creation Hatchery Center, Tohoku University, 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai 980-8579, Japan"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"New Industry Creation Hatchery Center, Tohoku University, 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai 980-8579, Japan","institution_ids":["https://openalex.org/I201537933","https://openalex.org/I4405287282"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":3,"corresponding_author_ids":[],"corresponding_institution_ids":[],"apc_list":{"value":3930,"currency":"USD","value_usd":3930},"apc_paid":null,"fwci":0.1399,"has_fulltext":false,"cited_by_count":10,"citation_normalized_percentile":{"value":0.43255188,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":88,"max":98},"biblio":{"volume":"164","issue":"1","first_page":"9","last_page":"15"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10192","display_name":"Catalytic Processes in Materials Science","score":0.9984999895095825,"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/T10192","display_name":"Catalytic Processes in Materials Science","score":0.9984999895095825,"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/T10311","display_name":"Advancements in Solid Oxide Fuel Cells","score":0.0003000000142492354,"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/T11802","display_name":"Chemical Looping and Thermochemical Processes","score":0.00019999999494757503,"subfield":{"id":"https://openalex.org/subfields/2103","display_name":"Fuel Technology"},"field":{"id":"https://openalex.org/fields/21","display_name":"Energy"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/cerium-oxide","display_name":"cerium oxide","score":0.8379999995231628},{"id":"https://openalex.org/keywords/hydrogen-reduction","display_name":"hydrogen reduction","score":0.800000011920929},{"id":"https://openalex.org/keywords/water-desorption","display_name":"water desorption","score":0.8629999756813049},{"id":"https://openalex.org/keywords/surface-reduction","display_name":"surface reduction","score":0.3619999885559082},{"id":"https://openalex.org/keywords/oxygen-storage","display_name":"oxygen storage","score":0.34599998593330383},{"id":"https://openalex.org/keywords/111-surface","display_name":"(111) surface","score":0.7710000276565552},{"id":"https://openalex.org/keywords/110-surface","display_name":"(110) surface","score":1.0},{"id":"https://openalex.org/keywords/hydrogen-adsorption","display_name":"hydrogen adsorption","score":0.6850000023841858},{"id":"https://openalex.org/keywords/quantum-chemical-molecular-dynamics","display_name":"quantum chemical molecular dynamics","score":0.7250000238418579}],"concepts":[{"id":"https://openalex.org/C2780657402","wikidata":"https://www.wikidata.org/wiki/Q1055570","display_name":"Cerium oxide","level":3,"score":0.8017777800559998},{"id":"https://openalex.org/C523597863","wikidata":"https://www.wikidata.org/wiki/Q1385","display_name":"Cerium","level":2,"score":0.6163361072540283},{"id":"https://openalex.org/C2991951333","wikidata":"https://www.wikidata.org/wiki/Q188403","display_name":"Quantum chemical","level":3,"score":0.5972023606300354},{"id":"https://openalex.org/C111335779","wikidata":"https://www.wikidata.org/wiki/Q3454686","display_name":"Reduction (mathematics)","level":2,"score":0.5936605930328369},{"id":"https://openalex.org/C161790260","wikidata":"https://www.wikidata.org/wiki/Q82264","display_name":"Catalysis","level":2,"score":0.573747456073761},{"id":"https://openalex.org/C175583648","wikidata":"https://www.wikidata.org/wiki/Q903156","display_name":"Heterogeneous catalysis","level":3,"score":0.49692896008491516},{"id":"https://openalex.org/C2779851234","wikidata":"https://www.wikidata.org/wiki/Q50690","display_name":"Oxide","level":2,"score":0.49137797951698303},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.4564216136932373},{"id":"https://openalex.org/C2776799497","wikidata":"https://www.wikidata.org/wiki/Q484298","display_name":"Surface (topology)","level":2,"score":0.420507550239563},{"id":"https://openalex.org/C179104552","wikidata":"https://www.wikidata.org/wiki/Q11165","display_name":"Inorganic chemistry","level":1,"score":0.3876704275608063},{"id":"https://openalex.org/C192562407","wikidata":"https://www.wikidata.org/wiki/Q228736","display_name":"Materials science","level":0,"score":0.38453763723373413},{"id":"https://openalex.org/C42360764","wikidata":"https://www.wikidata.org/wiki/Q83588","display_name":"Chemical engineering","level":1,"score":0.37472790479660034},{"id":"https://openalex.org/C32909587","wikidata":"https://www.wikidata.org/wiki/Q11369","display_name":"Molecule","level":2,"score":0.22046500444412231},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.14741414785385132},{"id":"https://openalex.org/C2524010","wikidata":"https://www.wikidata.org/wiki/Q8087","display_name":"Geometry","level":1,"score":0.0},{"id":"https://openalex.org/C33923547","wikidata":"https://www.wikidata.org/wiki/Q395","display_name":"Mathematics","level":0,"score":0.0},{"id":"https://openalex.org/C127413603","wikidata":"https://www.wikidata.org/wiki/Q11023","display_name":"Engineering","level":0,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1016/j.cattod.2010.10.011","doi":"https://doi.org/10.1016/j.cattod.2010.10.011","is_oa":false,"landing_page_url":"https://doi.org/10.1016/j.cattod.2010.10.011","pdf_url":null,"source":{"id":"https://openalex.org/S117279562","display_name":"Catalysis Today","issn_l":"0920-5861","issn":["0920-5861","1873-4308"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["anvur-scientific","cwts-core","dongbi-b","jufo-1","norway-2","poland-140","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":"Catalysis Today","raw_type":"journal-article"}],"best_oa_location":null,"sustainable_development_goals":[],"study_designs":[],"awards":[{"id":"https://openalex.org/G6208043502","display_name":"Development of Multi-level Tribology Simulator based on Ultra-accelerated Quantum Chemical Molecular Dynamics","funder_award_id":"20226005","funder_id":"https://openalex.org/F4320334764","funder_display_name":"Japan Society for the Promotion of Science"},{"id":"https://openalex.org/G7968666422","display_name":"Development of Practical Simulator of Interconnect Lifetime Based on Quantum Theory","funder_award_id":"21360158","funder_id":"https://openalex.org/F4320334764","funder_display_name":"Japan Society for the Promotion of Science"}],"funders":[{"id":"https://openalex.org/F4320334764","display_name":"Japan Society for the Promotion of Science","ror":"https://ror.org/00hhkn466"}],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":44,"referenced_works":["https://openalex.org/W123083430","https://openalex.org/W155312606","https://openalex.org/W1573584363","https://openalex.org/W1964720728","https://openalex.org/W1966890119","https://openalex.org/W1981368803","https://openalex.org/W1982106179","https://openalex.org/W1982522401","https://openalex.org/W1983816985","https://openalex.org/W1984147706","https://openalex.org/W1984335774","https://openalex.org/W1992854368","https://openalex.org/W1995379479","https://openalex.org/W1996783220","https://openalex.org/W1997343992","https://openalex.org/W2001676859","https://openalex.org/W2003226711","https://openalex.org/W2008548115","https://openalex.org/W2008733486","https://openalex.org/W2018546048","https://openalex.org/W2022103115","https://openalex.org/W2024722060","https://openalex.org/W2028098830","https://openalex.org/W2029125545","https://openalex.org/W2037478455","https://openalex.org/W2038533471","https://openalex.org/W2040816833","https://openalex.org/W2041489653","https://openalex.org/W2061631080","https://openalex.org/W2064413263","https://openalex.org/W2065828903","https://openalex.org/W2070753190","https://openalex.org/W2071523173","https://openalex.org/W2071955309","https://openalex.org/W2076802126","https://openalex.org/W2080097545","https://openalex.org/W2084165466","https://openalex.org/W2088124227","https://openalex.org/W2088964428","https://openalex.org/W2109639556","https://openalex.org/W2151569371","https://openalex.org/W2166657032","https://openalex.org/W2252709902","https://openalex.org/W2323178299"],"related_works":["https://openalex.org/W2014560391","https://openalex.org/W2302249387","https://openalex.org/W4410396396","https://openalex.org/W3216564460","https://openalex.org/W3116016030","https://openalex.org/W3006827132","https://openalex.org/W1983816985","https://openalex.org/W2061631080","https://openalex.org/W2144085089","https://openalex.org/W4392722149"],"abstract_inverted_index":null,"counts_by_year":[{"year":2020,"cited_by_count":1},{"year":2019,"cited_by_count":1},{"year":2017,"cited_by_count":1},{"year":2015,"cited_by_count":1},{"year":2014,"cited_by_count":5},{"year":2013,"cited_by_count":1}],"updated_date":"2026-10-24T09:50:30.924529","created_date":"2016-06-24T00:00:00"}
