{"id":"https://openalex.org/W2767083894","doi":"https://doi.org/10.1007/978-3-319-67630-2_30","title":"Performance Evaluation of NWChem Ab-Initio Molecular Dynamics (AIMD) Simulations on the Intel\u00ae Xeon Phi\u2122 Processor","display_name":"Performance Evaluation of NWChem Ab-Initio Molecular Dynamics (AIMD) Simulations on the Intel\u00ae Xeon Phi\u2122 Processor","publication_year":2017,"publication_date":"2017-01-01","ids":{"openalex":"https://openalex.org/W2767083894","doi":"https://doi.org/10.1007/978-3-319-67630-2_30","mag":"2767083894"},"language":"en","primary_location":{"id":"doi:10.1007/978-3-319-67630-2_30","is_oa":false,"landing_page_url":"https://doi.org/10.1007/978-3-319-67630-2_30","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":["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/A5056598051","display_name":"Eric J. Bylaska","orcid":"https://orcid.org/0000-0001-6405-599X"},"institutions":[{"id":"https://openalex.org/I142606810","display_name":"Pacific Northwest National Laboratory","ror":"https://ror.org/05h992307","country_code":"US","type":"facility","lineage":["https://openalex.org/I1325736334","https://openalex.org/I1330989302","https://openalex.org/I142606810","https://openalex.org/I39565521"]},{"id":"https://openalex.org/I2801280572","display_name":"Environmental Molecular Sciences Laboratory","ror":"https://ror.org/04rc0xn13","country_code":"US","type":"facility","lineage":["https://openalex.org/I1325736334","https://openalex.org/I1330989302","https://openalex.org/I142606810","https://openalex.org/I2801280572","https://openalex.org/I39565521"]}],"countries":["US"],"is_corresponding":true,"raw_author_name":"Eric J. Bylaska","raw_affiliation_strings":["Environmental Molecular Sciences Laboratory, Pacific Northwest National Laboratory, Richland, WA, USA"],"affiliations":[{"raw_affiliation_string":"Environmental Molecular Sciences Laboratory, Pacific Northwest National Laboratory, Richland, WA, USA","institution_ids":["https://openalex.org/I2801280572","https://openalex.org/I142606810"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5077299278","display_name":"Mathias Jacquelin","orcid":"https://orcid.org/0000-0002-3137-166X"},"institutions":[{"id":"https://openalex.org/I148283060","display_name":"Lawrence Berkeley National Laboratory","ror":"https://ror.org/02jbv0t02","country_code":"US","type":"facility","lineage":["https://openalex.org/I1330989302","https://openalex.org/I148283060","https://openalex.org/I39565521"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Mathias Jacquelin","raw_affiliation_strings":["Computational Research Division, Lawrence Berkeley National Laboratory, Berkeley, CA, USA"],"affiliations":[{"raw_affiliation_string":"Computational Research Division, Lawrence Berkeley National Laboratory, Berkeley, CA, USA","institution_ids":["https://openalex.org/I148283060"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5034688782","display_name":"Wibe A. de Jong","orcid":"https://orcid.org/0000-0002-7114-8315"},"institutions":[{"id":"https://openalex.org/I148283060","display_name":"Lawrence Berkeley National Laboratory","ror":"https://ror.org/02jbv0t02","country_code":"US","type":"facility","lineage":["https://openalex.org/I1330989302","https://openalex.org/I148283060","https://openalex.org/I39565521"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Wibe A. de Jong","raw_affiliation_strings":["Computational Research Division, Lawrence Berkeley National Laboratory, Berkeley, CA, USA"],"affiliations":[{"raw_affiliation_string":"Computational Research Division, Lawrence Berkeley National Laboratory, Berkeley, CA, USA","institution_ids":["https://openalex.org/I148283060"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5081388506","display_name":"Jeff R. Hammond","orcid":"https://orcid.org/0000-0003-3181-8190"},"institutions":[{"id":"https://openalex.org/I1343180700","display_name":"Intel (United States)","ror":"https://ror.org/01ek73717","country_code":"US","type":"company","lineage":["https://openalex.org/I1343180700"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Jeff R. Hammond","raw_affiliation_strings":["Data Center Group, Intel Corporation, Portland, OR, USA"],"affiliations":[{"raw_affiliation_string":"Data Center Group, Intel Corporation, Portland, OR, USA","institution_ids":["https://openalex.org/I1343180700"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5077020955","display_name":"Michael Klemm","orcid":"https://orcid.org/0000-0002-8634-4634"},"institutions":[{"id":"https://openalex.org/I4210094487","display_name":"Intel (Germany)","ror":"https://ror.org/00m2x0g47","country_code":"DE","type":"company","lineage":["https://openalex.org/I1343180700","https://openalex.org/I4210094487"]}],"countries":["DE"],"is_corresponding":false,"raw_author_name":"Michael Klemm","raw_affiliation_strings":["Software and Services Group, Intel Deutschland GmbH, Feldkirchen, Germany"],"affiliations":[{"raw_affiliation_string":"Software and Services Group, Intel Deutschland GmbH, Feldkirchen, Germany","institution_ids":["https://openalex.org/I4210094487"]}]}],"institutions":[],"countries_distinct_count":2,"institutions_distinct_count":5,"corresponding_author_ids":["https://openalex.org/A5056598051"],"corresponding_institution_ids":["https://openalex.org/I142606810","https://openalex.org/I2801280572"],"apc_list":{"value":5000,"currency":"EUR","value_usd":5392},"apc_paid":null,"fwci":2.6493,"has_fulltext":false,"cited_by_count":7,"citation_normalized_percentile":{"value":0.90298507,"is_in_top_1_percent":false,"is_in_top_10_percent":true},"cited_by_percentile_year":{"min":89,"max":97},"biblio":{"volume":null,"issue":null,"first_page":"404","last_page":"418"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10054","display_name":"Parallel Computing and Optimization Techniques","score":0.9997000098228455,"subfield":{"id":"https://openalex.org/subfields/1708","display_name":"Hardware and Architecture"},"field":{"id":"https://openalex.org/fields/17","display_name":"Computer Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T10054","display_name":"Parallel Computing and Optimization Techniques","score":0.9997000098228455,"subfield":{"id":"https://openalex.org/subfields/1708","display_name":"Hardware and Architecture"},"field":{"id":"https://openalex.org/fields/17","display_name":"Computer Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T11181","display_name":"Advanced Data Storage Technologies","score":0.9962000250816345,"subfield":{"id":"https://openalex.org/subfields/1705","display_name":"Computer Networks and Communications"},"field":{"id":"https://openalex.org/fields/17","display_name":"Computer Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T10715","display_name":"Distributed and Parallel Computing Systems","score":0.9937999844551086,"subfield":{"id":"https://openalex.org/subfields/1705","display_name":"Computer Networks and Communications"},"field":{"id":"https://openalex.org/fields/17","display_name":"Computer Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/xeon-phi","display_name":"Xeon Phi","score":0.9524874687194824},{"id":"https://openalex.org/keywords/computer-science","display_name":"Computer science","score":0.8396288156509399},{"id":"https://openalex.org/keywords/xeon","display_name":"Xeon","score":0.7163001894950867},{"id":"https://openalex.org/keywords/parallel-computing","display_name":"Parallel computing","score":0.7118340730667114},{"id":"https://openalex.org/keywords/multi-core-processor","display_name":"Multi-core processor","score":0.5331323146820068},{"id":"https://openalex.org/keywords/scalability","display_name":"Scalability","score":0.5296915173530579},{"id":"https://openalex.org/keywords/computational-science","display_name":"Computational science","score":0.4901300370693207},{"id":"https://openalex.org/keywords/cluster","display_name":"Cluster (spacecraft)","score":0.4422876238822937},{"id":"https://openalex.org/keywords/operating-system","display_name":"Operating system","score":0.1089971661567688}],"concepts":[{"id":"https://openalex.org/C96972482","wikidata":"https://www.wikidata.org/wiki/Q1049168","display_name":"Xeon Phi","level":2,"score":0.9524874687194824},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.8396288156509399},{"id":"https://openalex.org/C145108525","wikidata":"https://www.wikidata.org/wiki/Q656154","display_name":"Xeon","level":2,"score":0.7163001894950867},{"id":"https://openalex.org/C173608175","wikidata":"https://www.wikidata.org/wiki/Q232661","display_name":"Parallel computing","level":1,"score":0.7118340730667114},{"id":"https://openalex.org/C78766204","wikidata":"https://www.wikidata.org/wiki/Q555032","display_name":"Multi-core processor","level":2,"score":0.5331323146820068},{"id":"https://openalex.org/C48044578","wikidata":"https://www.wikidata.org/wiki/Q727490","display_name":"Scalability","level":2,"score":0.5296915173530579},{"id":"https://openalex.org/C459310","wikidata":"https://www.wikidata.org/wiki/Q117801","display_name":"Computational science","level":1,"score":0.4901300370693207},{"id":"https://openalex.org/C164866538","wikidata":"https://www.wikidata.org/wiki/Q367351","display_name":"Cluster (spacecraft)","level":2,"score":0.4422876238822937},{"id":"https://openalex.org/C111919701","wikidata":"https://www.wikidata.org/wiki/Q9135","display_name":"Operating system","level":1,"score":0.1089971661567688}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1007/978-3-319-67630-2_30","is_oa":false,"landing_page_url":"https://doi.org/10.1007/978-3-319-67630-2_30","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"}],"best_oa_location":null,"sustainable_development_goals":[{"display_name":"Affordable and clean energy","id":"https://metadata.un.org/sdg/7","score":0.4399999976158142}],"awards":[],"funders":[],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":34,"referenced_works":["https://openalex.org/W1550061415","https://openalex.org/W1575350781","https://openalex.org/W1600349401","https://openalex.org/W1606899393","https://openalex.org/W1641750576","https://openalex.org/W1987497701","https://openalex.org/W1988888548","https://openalex.org/W2002555321","https://openalex.org/W2006981799","https://openalex.org/W2010707724","https://openalex.org/W2017113395","https://openalex.org/W2045462595","https://openalex.org/W2046001409","https://openalex.org/W2047283689","https://openalex.org/W2049804240","https://openalex.org/W2056999868","https://openalex.org/W2073566672","https://openalex.org/W2098432400","https://openalex.org/W2111320011","https://openalex.org/W2138782497","https://openalex.org/W2155187164","https://openalex.org/W2168425706","https://openalex.org/W2230728100","https://openalex.org/W2269751313","https://openalex.org/W2286402374","https://openalex.org/W2396033431","https://openalex.org/W2475636809","https://openalex.org/W2517065504","https://openalex.org/W2562130663","https://openalex.org/W2729169124","https://openalex.org/W3104999338","https://openalex.org/W4247058190","https://openalex.org/W4388319978","https://openalex.org/W6600020421"],"related_works":["https://openalex.org/W2739740241","https://openalex.org/W1974923383","https://openalex.org/W2085105049","https://openalex.org/W2475524688","https://openalex.org/W2526069705","https://openalex.org/W2024016913","https://openalex.org/W2019153376","https://openalex.org/W2981664121","https://openalex.org/W2796552083","https://openalex.org/W2022666014"],"abstract_inverted_index":null,"counts_by_year":[{"year":2022,"cited_by_count":1},{"year":2021,"cited_by_count":1},{"year":2020,"cited_by_count":4},{"year":2017,"cited_by_count":1}],"updated_date":"2025-11-06T03:46:38.306776","created_date":"2025-10-10T00:00:00"}