{"id":"https://openalex.org/W3092936543","doi":"https://doi.org/10.1016/j.parco.2020.102703","title":"A parallel strategy for density functional theory computations on accelerated nodes","display_name":"A parallel strategy for density functional theory computations on accelerated nodes","publication_year":2020,"publication_date":"2020-10-15","ids":{"openalex":"https://openalex.org/W3092936543","doi":"https://doi.org/10.1016/j.parco.2020.102703","mag":"3092936543"},"language":"en","primary_location":{"is_oa":true,"landing_page_url":"https://doi.org/10.1016/j.parco.2020.102703","pdf_url":"https://www.sciencedirect.com/science/article/am/pii/S0167819120300910","source":{"id":"https://openalex.org/S112708030","display_name":"Parallel Computing","issn_l":"0167-8191","issn":["0167-8191","1872-7336"],"is_oa":false,"is_in_doaj":false,"is_core":true,"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":"publisher-specific-oa","license_id":"https://openalex.org/licenses/publisher-specific-oa","version":"acceptedVersion","is_accepted":true,"is_published":false},"type":"article","type_crossref":"journal-article","indexed_in":["crossref"],"open_access":{"is_oa":true,"oa_status":"bronze","oa_url":"https://www.sciencedirect.com/science/article/am/pii/S0167819120300910","any_repository_has_fulltext":true},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5019108731","display_name":"Massimiliano Lupo Pasini","orcid":"https://orcid.org/0000-0002-4980-6924"},"institutions":[{"id":"https://openalex.org/I1289243028","display_name":"Oak Ridge National Laboratory","ror":"https://ror.org/01qz5mb56","country_code":"US","type":"facility","lineage":["https://openalex.org/I1289243028","https://openalex.org/I1330989302","https://openalex.org/I39565521","https://openalex.org/I4210159294"]}],"countries":["US"],"is_corresponding":true,"raw_author_name":"Massimiliano Lupo Pasini","raw_affiliation_strings":["Oak Ridge National Laboratory, Computational Sciences and Engineering Division, 1 Bethel Valley Road, Oak Ridge, TN, 37831, USA"],"affiliations":[{"raw_affiliation_string":"Oak Ridge National Laboratory, Computational Sciences and Engineering Division, 1 Bethel Valley Road, Oak Ridge, TN, 37831, USA","institution_ids":["https://openalex.org/I1289243028"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5003571769","display_name":"Bruno Turcksin","orcid":"https://orcid.org/0000-0001-5954-6313"},"institutions":[{"id":"https://openalex.org/I1289243028","display_name":"Oak Ridge National Laboratory","ror":"https://ror.org/01qz5mb56","country_code":"US","type":"facility","lineage":["https://openalex.org/I1289243028","https://openalex.org/I1330989302","https://openalex.org/I39565521","https://openalex.org/I4210159294"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Bruno Turcksin","raw_affiliation_strings":["Oak Ridge National Laboratory, Computational Sciences and Engineering Division, 1 Bethel Valley Road, Oak Ridge, TN, 37831, USA"],"affiliations":[{"raw_affiliation_string":"Oak Ridge National Laboratory, Computational Sciences and Engineering Division, 1 Bethel Valley Road, Oak Ridge, TN, 37831, USA","institution_ids":["https://openalex.org/I1289243028"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5028916172","display_name":"Wenjun Ge","orcid":"https://orcid.org/0000-0002-3113-5915"},"institutions":[{"id":"https://openalex.org/I1289243028","display_name":"Oak Ridge National Laboratory","ror":"https://ror.org/01qz5mb56","country_code":"US","type":"facility","lineage":["https://openalex.org/I1289243028","https://openalex.org/I1330989302","https://openalex.org/I39565521","https://openalex.org/I4210159294"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Wenjun Ge","raw_affiliation_strings":["Oak Ridge National Laboratory, Computational Sciences and Engineering Division, 1 Bethel Valley Road, Oak Ridge, TN, 37831, USA"],"affiliations":[{"raw_affiliation_string":"Oak Ridge National Laboratory, Computational Sciences and Engineering Division, 1 Bethel Valley Road, Oak Ridge, TN, 37831, USA","institution_ids":["https://openalex.org/I1289243028"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5064007349","display_name":"Jean\u2010Luc Fattebert","orcid":"https://orcid.org/0000-0002-1455-6160"},"institutions":[{"id":"https://openalex.org/I1289243028","display_name":"Oak Ridge National Laboratory","ror":"https://ror.org/01qz5mb56","country_code":"US","type":"facility","lineage":["https://openalex.org/I1289243028","https://openalex.org/I1330989302","https://openalex.org/I39565521","https://openalex.org/I4210159294"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Jean-Luc Fattebert","raw_affiliation_strings":["Oak Ridge National Laboratory, Computational Sciences and Engineering Division, 1 Bethel Valley Road, Oak Ridge, TN, 37831, USA"],"affiliations":[{"raw_affiliation_string":"Oak Ridge National Laboratory, Computational Sciences and Engineering Division, 1 Bethel Valley Road, Oak Ridge, TN, 37831, USA","institution_ids":["https://openalex.org/I1289243028"]}]}],"institution_assertions":[],"countries_distinct_count":1,"institutions_distinct_count":1,"corresponding_author_ids":["https://openalex.org/A5019108731"],"corresponding_institution_ids":["https://openalex.org/I1289243028"],"apc_list":{"value":2680,"currency":"USD","value_usd":2680,"provenance":"doaj"},"apc_paid":null,"fwci":0.293,"has_fulltext":false,"cited_by_count":5,"citation_normalized_percentile":{"value":0.453459,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":79,"max":81},"biblio":{"volume":"100","issue":null,"first_page":"102703","last_page":"102703"},"is_retracted":false,"is_paratext":false,"primary_topic":{"id":"https://openalex.org/T11177","display_name":"Spectroscopy and Quantum Chemical Studies","score":0.996,"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/T11177","display_name":"Spectroscopy and Quantum Chemical Studies","score":0.996,"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/T10591","display_name":"Theoretical and Computational Physics","score":0.9956,"subfield":{"id":"https://openalex.org/subfields/3104","display_name":"Condensed Matter Physics"},"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/T11804","display_name":"Quantum many-body systems","score":0.9945,"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/graphics-processing-unit","display_name":"Graphics processing unit","score":0.61508465},{"id":"https://openalex.org/keywords/solver","display_name":"Solver","score":0.5130028}],"concepts":[{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.7240545},{"id":"https://openalex.org/C2779851693","wikidata":"https://www.wikidata.org/wiki/Q183484","display_name":"Graphics processing unit","level":2,"score":0.61508465},{"id":"https://openalex.org/C45374587","wikidata":"https://www.wikidata.org/wiki/Q12525525","display_name":"Computation","level":2,"score":0.57964045},{"id":"https://openalex.org/C173608175","wikidata":"https://www.wikidata.org/wiki/Q232661","display_name":"Parallel computing","level":1,"score":0.513044},{"id":"https://openalex.org/C2778770139","wikidata":"https://www.wikidata.org/wiki/Q1966904","display_name":"Solver","level":2,"score":0.5130028},{"id":"https://openalex.org/C459310","wikidata":"https://www.wikidata.org/wiki/Q117801","display_name":"Computational science","level":1,"score":0.51191413},{"id":"https://openalex.org/C21442007","wikidata":"https://www.wikidata.org/wiki/Q1027879","display_name":"Graphics","level":2,"score":0.44186234},{"id":"https://openalex.org/C151201525","wikidata":"https://www.wikidata.org/wiki/Q177239","display_name":"Limit (mathematics)","level":2,"score":0.42597738},{"id":"https://openalex.org/C11413529","wikidata":"https://www.wikidata.org/wiki/Q8366","display_name":"Algorithm","level":1,"score":0.2609868},{"id":"https://openalex.org/C33923547","wikidata":"https://www.wikidata.org/wiki/Q395","display_name":"Mathematics","level":0,"score":0.16708973},{"id":"https://openalex.org/C134306372","wikidata":"https://www.wikidata.org/wiki/Q7754","display_name":"Mathematical analysis","level":1,"score":0.0},{"id":"https://openalex.org/C121684516","wikidata":"https://www.wikidata.org/wiki/Q7600677","display_name":"Computer graphics (images)","level":1,"score":0.0},{"id":"https://openalex.org/C199360897","wikidata":"https://www.wikidata.org/wiki/Q9143","display_name":"Programming language","level":1,"score":0.0}],"mesh":[],"locations_count":3,"locations":[{"is_oa":true,"landing_page_url":"https://doi.org/10.1016/j.parco.2020.102703","pdf_url":"https://www.sciencedirect.com/science/article/am/pii/S0167819120300910","source":{"id":"https://openalex.org/S112708030","display_name":"Parallel Computing","issn_l":"0167-8191","issn":["0167-8191","1872-7336"],"is_oa":false,"is_in_doaj":false,"is_core":true,"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":"publisher-specific-oa","license_id":"https://openalex.org/licenses/publisher-specific-oa","version":"acceptedVersion","is_accepted":true,"is_published":false},{"is_oa":false,"landing_page_url":"https://www.osti.gov/biblio/1809491","pdf_url":null,"source":{"id":"https://openalex.org/S4306402487","display_name":"OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)","issn_l":null,"issn":null,"is_oa":true,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I139351228","host_organization_name":"Office of Scientific and Technical Information","host_organization_lineage":["https://openalex.org/I139351228"],"host_organization_lineage_names":["Office of Scientific and Technical Information"],"type":"repository"},"license":null,"license_id":null,"version":null,"is_accepted":false,"is_published":false},{"is_oa":true,"landing_page_url":"https://www.osti.gov/biblio/1731060","pdf_url":null,"source":{"id":"https://openalex.org/S4306402487","display_name":"OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)","issn_l":null,"issn":null,"is_oa":true,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I139351228","host_organization_name":"Office of Scientific and Technical Information","host_organization_lineage":["https://openalex.org/I139351228"],"host_organization_lineage_names":["Office of Scientific and Technical Information"],"type":"repository"},"license":"other-oa","license_id":"https://openalex.org/licenses/other-oa","version":"submittedVersion","is_accepted":false,"is_published":false}],"best_oa_location":{"is_oa":true,"landing_page_url":"https://doi.org/10.1016/j.parco.2020.102703","pdf_url":"https://www.sciencedirect.com/science/article/am/pii/S0167819120300910","source":{"id":"https://openalex.org/S112708030","display_name":"Parallel Computing","issn_l":"0167-8191","issn":["0167-8191","1872-7336"],"is_oa":false,"is_in_doaj":false,"is_core":true,"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":"publisher-specific-oa","license_id":"https://openalex.org/licenses/publisher-specific-oa","version":"acceptedVersion","is_accepted":true,"is_published":false},"sustainable_development_goals":[],"grants":[{"funder":"https://openalex.org/F4320316892","funder_display_name":"UT-Battelle","award_id":null},{"funder":"https://openalex.org/F4320338287","funder_display_name":"Oak Ridge National Laboratory","award_id":null}],"datasets":[],"versions":[],"referenced_works_count":42,"referenced_works":["https://openalex.org/W1493774699","https://openalex.org/W1558296484","https://openalex.org/W1826072219","https://openalex.org/W1969704700","https://openalex.org/W1974974739","https://openalex.org/W1985384559","https://openalex.org/W1986751761","https://openalex.org/W1988809402","https://openalex.org/W2001135345","https://openalex.org/W2006569455","https://openalex.org/W2027353946","https://openalex.org/W2030976617","https://openalex.org/W2035266229","https://openalex.org/W2041902442","https://openalex.org/W2051142108","https://openalex.org/W2055578689","https://openalex.org/W2082222119","https://openalex.org/W2105564187","https://openalex.org/W2111108058","https://openalex.org/W2116732229","https://openalex.org/W2130604611","https://openalex.org/W2148424525","https://openalex.org/W2149227288","https://openalex.org/W2153603741","https://openalex.org/W2160089699","https://openalex.org/W2230728100","https://openalex.org/W2240679564","https://openalex.org/W2318319753","https://openalex.org/W2562130663","https://openalex.org/W2563513434","https://openalex.org/W2610857016","https://openalex.org/W2915044281","https://openalex.org/W2983200159","https://openalex.org/W2996943949","https://openalex.org/W2997878467","https://openalex.org/W3102798902","https://openalex.org/W3104616705","https://openalex.org/W36826159","https://openalex.org/W4231577184","https://openalex.org/W4234422595","https://openalex.org/W4247058190","https://openalex.org/W4301844547"],"related_works":["https://openalex.org/W4367553810","https://openalex.org/W4283162424","https://openalex.org/W2804126825","https://openalex.org/W2731831065","https://openalex.org/W2220968517","https://openalex.org/W2163816448","https://openalex.org/W2104142636","https://openalex.org/W2015141752","https://openalex.org/W1604758548","https://openalex.org/W1549048322"],"abstract_inverted_index":null,"cited_by_api_url":"https://api.openalex.org/works?filter=cites:W3092936543","counts_by_year":[{"year":2024,"cited_by_count":2},{"year":2023,"cited_by_count":3}],"updated_date":"2024-12-13T15:01:29.885783","created_date":"2020-10-22"}