{"id":"https://openalex.org/W2101222585","doi":"https://doi.org/10.1177/109434209801200304","title":"ChemIo: High Performance Parallel I/o for Computational Chemistry Applications","display_name":"ChemIo: High Performance Parallel I/o for Computational Chemistry Applications","publication_year":1998,"publication_date":"1998-09-01","ids":{"openalex":"https://openalex.org/W2101222585","doi":"https://doi.org/10.1177/109434209801200304","mag":"2101222585"},"language":"en","primary_location":{"id":"doi:10.1177/109434209801200304","is_oa":false,"landing_page_url":"https://doi.org/10.1177/109434209801200304","pdf_url":null,"source":{"id":"https://openalex.org/S60606485","display_name":"The International Journal of High Performance Computing Applications","issn_l":"1094-3420","issn":["1094-3420","1741-2846"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310320017","host_organization_name":"SAGE Publishing","host_organization_lineage":["https://openalex.org/P4310320017"],"host_organization_lineage_names":["SAGE Publishing"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"The International Journal of High Performance Computing Applications","raw_type":"journal-article"},"type":"article","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/A5047131679","display_name":"Jarek Nieplocha","orcid":null},"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"]}],"countries":["US"],"is_corresponding":true,"raw_author_name":"Jarek Nieplocha","raw_affiliation_strings":["Pacific Northwest National Laboratory, MSIN:K1-87,\rP.O. Box 999, Richland, WA 99352","Pacific Northwest National Laboratory, MSIN:K1-87,#R#P.O. Box 999, Richland, WA 99352"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Pacific Northwest National Laboratory, MSIN:K1-87,\rP.O. Box 999, Richland, WA 99352","institution_ids":["https://openalex.org/I142606810"]},{"raw_affiliation_string":"Pacific Northwest National Laboratory, MSIN:K1-87,#R#P.O. Box 999, Richland, WA 99352","institution_ids":["https://openalex.org/I142606810"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5032231503","display_name":"Ian Foster","orcid":"https://orcid.org/0000-0003-2129-5269"},"institutions":[{"id":"https://openalex.org/I1282105669","display_name":"Argonne National Laboratory","ror":"https://ror.org/05gvnxz63","country_code":"US","type":"facility","lineage":["https://openalex.org/I1282105669","https://openalex.org/I1330989302","https://openalex.org/I39565521","https://openalex.org/I40347166"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Ian Foster","raw_affiliation_strings":["ARGONNE NATIONAL LABORATORY, ARGONNE, ILLINOIS, U.S.A","Argonne National Laboratory, Argonne, Illinois, U. S. A"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"ARGONNE NATIONAL LABORATORY, ARGONNE, ILLINOIS, U.S.A","institution_ids":["https://openalex.org/I1282105669"]},{"raw_affiliation_string":"Argonne National Laboratory, Argonne, Illinois, U. S. A","institution_ids":["https://openalex.org/I1282105669"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5109449562","display_name":"Rick A. Kendall","orcid":null},"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"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Rick A. Kendall","raw_affiliation_strings":["PACIFIC NORTHWEST NATIONAL LABORATORY, RICHLAND, WASHINGTON,\rU.S.A","Pacific Northwest National Laboratory, Richland, Washington, U. S. A"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"PACIFIC NORTHWEST NATIONAL LABORATORY, RICHLAND, WASHINGTON,\rU.S.A","institution_ids":["https://openalex.org/I142606810"]},{"raw_affiliation_string":"Pacific Northwest National Laboratory, Richland, Washington, U. S. A","institution_ids":["https://openalex.org/I142606810"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":3,"corresponding_author_ids":["https://openalex.org/A5047131679"],"corresponding_institution_ids":["https://openalex.org/I142606810"],"apc_list":null,"apc_paid":null,"fwci":2.6499,"has_fulltext":false,"cited_by_count":33,"citation_normalized_percentile":{"value":0.91042401,"is_in_top_1_percent":false,"is_in_top_10_percent":true},"cited_by_percentile_year":{"min":90,"max":96},"biblio":{"volume":"12","issue":"3","first_page":"345","last_page":"363"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10715","display_name":"Distributed and Parallel Computing Systems","score":0.9984999895095825,"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"}},"topics":[{"id":"https://openalex.org/T10715","display_name":"Distributed and Parallel Computing Systems","score":0.9984999895095825,"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/T11181","display_name":"Advanced Data Storage Technologies","score":0.9980999827384949,"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/T11986","display_name":"Scientific Computing and Data Management","score":0.9937999844551086,"subfield":{"id":"https://openalex.org/subfields/1802","display_name":"Information Systems and Management"},"field":{"id":"https://openalex.org/fields/18","display_name":"Decision Sciences"},"domain":{"id":"https://openalex.org/domains/2","display_name":"Social Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/computer-science","display_name":"Computer science","score":0.8409759402275085},{"id":"https://openalex.org/keywords/scalability","display_name":"Scalability","score":0.8015956878662109},{"id":"https://openalex.org/keywords/supercomputer","display_name":"Supercomputer","score":0.613723635673523},{"id":"https://openalex.org/keywords/parallel-computing","display_name":"Parallel computing","score":0.5951046943664551},{"id":"https://openalex.org/keywords/interface","display_name":"Interface (matter)","score":0.578575611114502},{"id":"https://openalex.org/keywords/implementation","display_name":"Implementation","score":0.5783035159111023},{"id":"https://openalex.org/keywords/computational-science","display_name":"Computational science","score":0.49465033411979675},{"id":"https://openalex.org/keywords/parallel-i/o","display_name":"Parallel I/O","score":0.49216288328170776},{"id":"https://openalex.org/keywords/distributed-computing","display_name":"Distributed computing","score":0.45231834053993225},{"id":"https://openalex.org/keywords/computation","display_name":"Computation","score":0.4401146173477173},{"id":"https://openalex.org/keywords/multi-core-processor","display_name":"Multi-core processor","score":0.42994844913482666},{"id":"https://openalex.org/keywords/computer-architecture","display_name":"Computer architecture","score":0.4041091799736023},{"id":"https://openalex.org/keywords/programming-language","display_name":"Programming language","score":0.21029508113861084},{"id":"https://openalex.org/keywords/operating-system","display_name":"Operating system","score":0.19841566681861877}],"concepts":[{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.8409759402275085},{"id":"https://openalex.org/C48044578","wikidata":"https://www.wikidata.org/wiki/Q727490","display_name":"Scalability","level":2,"score":0.8015956878662109},{"id":"https://openalex.org/C83283714","wikidata":"https://www.wikidata.org/wiki/Q121117","display_name":"Supercomputer","level":2,"score":0.613723635673523},{"id":"https://openalex.org/C173608175","wikidata":"https://www.wikidata.org/wiki/Q232661","display_name":"Parallel computing","level":1,"score":0.5951046943664551},{"id":"https://openalex.org/C113843644","wikidata":"https://www.wikidata.org/wiki/Q901882","display_name":"Interface (matter)","level":4,"score":0.578575611114502},{"id":"https://openalex.org/C26713055","wikidata":"https://www.wikidata.org/wiki/Q245962","display_name":"Implementation","level":2,"score":0.5783035159111023},{"id":"https://openalex.org/C459310","wikidata":"https://www.wikidata.org/wiki/Q117801","display_name":"Computational science","level":1,"score":0.49465033411979675},{"id":"https://openalex.org/C2781057727","wikidata":"https://www.wikidata.org/wiki/Q9941","display_name":"Parallel I/O","level":2,"score":0.49216288328170776},{"id":"https://openalex.org/C120314980","wikidata":"https://www.wikidata.org/wiki/Q180634","display_name":"Distributed computing","level":1,"score":0.45231834053993225},{"id":"https://openalex.org/C45374587","wikidata":"https://www.wikidata.org/wiki/Q12525525","display_name":"Computation","level":2,"score":0.4401146173477173},{"id":"https://openalex.org/C78766204","wikidata":"https://www.wikidata.org/wiki/Q555032","display_name":"Multi-core processor","level":2,"score":0.42994844913482666},{"id":"https://openalex.org/C118524514","wikidata":"https://www.wikidata.org/wiki/Q173212","display_name":"Computer architecture","level":1,"score":0.4041091799736023},{"id":"https://openalex.org/C199360897","wikidata":"https://www.wikidata.org/wiki/Q9143","display_name":"Programming language","level":1,"score":0.21029508113861084},{"id":"https://openalex.org/C111919701","wikidata":"https://www.wikidata.org/wiki/Q9135","display_name":"Operating system","level":1,"score":0.19841566681861877},{"id":"https://openalex.org/C129307140","wikidata":"https://www.wikidata.org/wiki/Q6795880","display_name":"Maximum bubble pressure method","level":3,"score":0.0},{"id":"https://openalex.org/C157915830","wikidata":"https://www.wikidata.org/wiki/Q2928001","display_name":"Bubble","level":2,"score":0.0}],"mesh":[],"locations_count":2,"locations":[{"id":"doi:10.1177/109434209801200304","is_oa":false,"landing_page_url":"https://doi.org/10.1177/109434209801200304","pdf_url":null,"source":{"id":"https://openalex.org/S60606485","display_name":"The International Journal of High Performance Computing Applications","issn_l":"1094-3420","issn":["1094-3420","1741-2846"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310320017","host_organization_name":"SAGE Publishing","host_organization_lineage":["https://openalex.org/P4310320017"],"host_organization_lineage_names":["SAGE Publishing"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"The International Journal of High Performance Computing Applications","raw_type":"journal-article"},{"id":"pmh:oai:CiteSeerX.psu:10.1.1.965.3395","is_oa":false,"landing_page_url":"http://citeseerx.ist.psu.edu/viewdoc/summary?doi=10.1.1.965.3395","pdf_url":null,"source":null,"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"http://hpc.sagepub.com/content/12/3/345.full.pdf","raw_type":"text"}],"best_oa_location":null,"sustainable_development_goals":[{"display_name":"Industry, innovation and infrastructure","id":"https://metadata.un.org/sdg/9","score":0.4099999964237213}],"awards":[],"funders":[],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":29,"referenced_works":["https://openalex.org/W11929518","https://openalex.org/W185134564","https://openalex.org/W1509074927","https://openalex.org/W1980788067","https://openalex.org/W2013540388","https://openalex.org/W2018179526","https://openalex.org/W2023339323","https://openalex.org/W2025262868","https://openalex.org/W2028370049","https://openalex.org/W2038305447","https://openalex.org/W2046770434","https://openalex.org/W2060657750","https://openalex.org/W2061453852","https://openalex.org/W2070868462","https://openalex.org/W2083111536","https://openalex.org/W2090683636","https://openalex.org/W2098228070","https://openalex.org/W2107806866","https://openalex.org/W2108155100","https://openalex.org/W2109665034","https://openalex.org/W2109982223","https://openalex.org/W2145760549","https://openalex.org/W2147303166","https://openalex.org/W2149970695","https://openalex.org/W2162286721","https://openalex.org/W2172446696","https://openalex.org/W3142551955","https://openalex.org/W4248548034","https://openalex.org/W4248885950"],"related_works":["https://openalex.org/W2364921833","https://openalex.org/W2488897859","https://openalex.org/W4206430307","https://openalex.org/W2546696010","https://openalex.org/W1970172627","https://openalex.org/W2555888817","https://openalex.org/W2793542907","https://openalex.org/W1561683466","https://openalex.org/W1972664035","https://openalex.org/W2042195538"],"abstract_inverted_index":{"Recent":[0],"developments":[1],"in":[2,13,71,107],"I/O":[3,51,63,68,97,111,121],"systems":[4],"on":[5,86,122],"scalable":[6,110,123],"parallel":[7,96,124],"computers":[8],"have":[9],"sparked":[10],"renewed":[11],"interest":[12],"out-of-core":[14,41],"methods":[15,20,42],"for":[16,95],"computational":[17,73],"chemistry.":[18],"These":[19],"can":[21],"improve":[22],"execution":[23],"time":[24],"significantly":[25],"relative":[26],"to":[27,117],"direct":[28],"methods,":[29],"which":[30],"perform":[31],"many":[32],"redundant":[33],"computations.":[34],"However,":[35],"the":[36,67,92,104,114],"widespread":[37],"use":[38],"of":[39,48,83],"such":[40],"requires":[43],"efficient":[44],"and":[45,76,99,113],"portable":[46],"implementations":[47],"often":[49],"complex":[50],"patterns.":[52],"The":[53],"ChemlO":[54],"project":[55],"has":[56],"addressed":[57],"this":[58,84],"problem":[59],"by":[60,77],"defining":[61],"an":[62],"interface":[64,85],"that":[65],"captures":[66],"patterns":[69],"found":[70],"important":[72],"chemistry":[74],"applications":[75],"providing":[78],"high":[79,119],"performance":[80,120],"imple":[81],"mentations":[82],"multiple":[87],"platforms.":[88],"This":[89],"development":[90],"broadens":[91],"user":[93],"community":[94],"techniques":[98,115],"provides":[100],"new":[101],"insights":[102],"into":[103],"functionality":[105],"required":[106,116],"general":[108],"purpose":[109],"libraries":[112],"achieve":[118],"computers.":[125]},"counts_by_year":[{"year":2014,"cited_by_count":1},{"year":2013,"cited_by_count":2}],"updated_date":"2026-05-21T06:26:12.895304","created_date":"2025-10-10T00:00:00"}