{"id":"https://openalex.org/W1963595290","doi":"https://doi.org/10.1016/j.molliq.2006.08.015","title":"MD simulations of proton transport along a model Nafion surface decorated with sulfonate groups","display_name":"MD simulations of proton transport along a model Nafion surface decorated with sulfonate groups","publication_year":2006,"publication_date":"2006-09-19","ids":{"openalex":"https://openalex.org/W1963595290","doi":"https://doi.org/10.1016/j.molliq.2006.08.015","mag":"1963595290"},"language":"en","primary_location":{"id":"doi:10.1016/j.molliq.2006.08.015","doi":"https://doi.org/10.1016/j.molliq.2006.08.015","is_oa":false,"landing_page_url":"https://doi.org/10.1016/j.molliq.2006.08.015","pdf_url":null,"source":{"id":"https://openalex.org/S189140625","display_name":"Journal of Molecular Liquids","issn_l":"0167-7322","issn":["0167-7322","1873-3166"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","jufo-1","ki-jl-1","norway-1","poland-100","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":"Journal of Molecular Liquids","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/A5039367290","display_name":"Supaporn Dokmaisrijan","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I171892758","display_name":"Forschungszentrum J\u00fclich","ror":"https://ror.org/02nv7yv05","country_code":"DE","type":"facility","lineage":["https://openalex.org/I1305996414","https://openalex.org/I171892758"]}],"countries":["DE"],"is_corresponding":false,"raw_author_name":"Supaporn Dokmaisrijan","raw_affiliation_strings":["Institut f\u00fcr Werkstoffe und Verfahren der Energietechnik, IWV-3, Forschungszentrum J\u00fclich, D-52428 J\u00fclich, Germany"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Institut f\u00fcr Werkstoffe und Verfahren der Energietechnik, IWV-3, Forschungszentrum J\u00fclich, D-52428 J\u00fclich, Germany","institution_ids":["https://openalex.org/I171892758"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5048562412","display_name":"Eckhard Spohr","orcid":"https://orcid.org/0000-0001-8148-7575","observed_orcids":["https://orcid.org/0000-0001-8148-7575"]},"institutions":[{"id":"https://openalex.org/I171892758","display_name":"Forschungszentrum J\u00fclich","ror":"https://ror.org/02nv7yv05","country_code":"DE","type":"facility","lineage":["https://openalex.org/I1305996414","https://openalex.org/I171892758"]}],"countries":["DE"],"is_corresponding":true,"raw_author_name":"Eckhard Spohr","raw_affiliation_strings":["Institut f\u00fcr Werkstoffe und Verfahren der Energietechnik, IWV-3, Forschungszentrum J\u00fclich, D-52428 J\u00fclich, Germany"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Institut f\u00fcr Werkstoffe und Verfahren der Energietechnik, IWV-3, Forschungszentrum J\u00fclich, D-52428 J\u00fclich, Germany","institution_ids":["https://openalex.org/I171892758"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":1,"corresponding_author_ids":["https://openalex.org/A5048562412"],"corresponding_institution_ids":["https://openalex.org/I171892758"],"apc_list":{"value":3480,"currency":"USD","value_usd":3480},"apc_paid":null,"fwci":6.1465,"has_fulltext":false,"cited_by_count":52,"citation_normalized_percentile":{"value":0.96093487,"is_in_top_1_percent":false,"is_in_top_10_percent":true},"cited_by_percentile_year":{"min":87,"max":97},"biblio":{"volume":"129","issue":"1-2","first_page":"92","last_page":"100"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10409","display_name":"Fuel Cells and Related Materials","score":0.9961000084877014,"subfield":{"id":"https://openalex.org/subfields/2208","display_name":"Electrical and Electronic Engineering"},"field":{"id":"https://openalex.org/fields/22","display_name":"Engineering"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T10409","display_name":"Fuel Cells and Related Materials","score":0.9961000084877014,"subfield":{"id":"https://openalex.org/subfields/2208","display_name":"Electrical and Electronic Engineering"},"field":{"id":"https://openalex.org/fields/22","display_name":"Engineering"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T11582","display_name":"Nanopore and Nanochannel Transport Studies","score":0.0008999999845400453,"subfield":{"id":"https://openalex.org/subfields/2204","display_name":"Biomedical Engineering"},"field":{"id":"https://openalex.org/fields/22","display_name":"Engineering"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T11177","display_name":"Spectroscopy and Quantum Chemical Studies","score":0.0003000000142492354,"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/proton-transport","display_name":"proton transport","score":0.9940000176429749},{"id":"https://openalex.org/keywords/nafion","display_name":"Nafion","score":0.8259999752044678},{"id":"https://openalex.org/keywords/sulfonate-groups","display_name":"sulfonate groups","score":0.902999997138977},{"id":"https://openalex.org/keywords/polymer-electrolyte-membranes","display_name":"polymer electrolyte membranes","score":0.9800000190734863},{"id":"https://openalex.org/keywords/aqueous-pores","display_name":"aqueous pores","score":0.6909999847412109},{"id":"https://openalex.org/keywords/proton-diffusion","display_name":"proton diffusion","score":0.47600001096725464},{"id":"https://openalex.org/keywords/hydrogen-fuel-cells","display_name":"hydrogen fuel cells","score":0.6729999780654907},{"id":"https://openalex.org/keywords/direct-methanol-fuel-cells","display_name":"direct methanol fuel cells","score":0.9940000176429749},{"id":"https://openalex.org/keywords/density-profile","display_name":"density profile","score":0.6620000004768372},{"id":"https://openalex.org/keywords/interfacial-region","display_name":"interfacial region","score":0.6039999723434448}],"concepts":[{"id":"https://openalex.org/C68801617","wikidata":"https://www.wikidata.org/wiki/Q162908","display_name":"Electrolyte","level":3,"score":0.7056748867034912},{"id":"https://openalex.org/C159467904","wikidata":"https://www.wikidata.org/wiki/Q2001702","display_name":"Chemical physics","level":1,"score":0.6232165098190308},{"id":"https://openalex.org/C54516573","wikidata":"https://www.wikidata.org/wiki/Q2294","display_name":"Proton","level":2,"score":0.6173783540725708},{"id":"https://openalex.org/C2992012372","wikidata":"https://www.wikidata.org/wiki/Q412272","display_name":"Proton transport","level":3,"score":0.6101086735725403},{"id":"https://openalex.org/C59593255","wikidata":"https://www.wikidata.org/wiki/Q901663","display_name":"Molecular dynamics","level":2,"score":0.5753044486045837},{"id":"https://openalex.org/C199631012","wikidata":"https://www.wikidata.org/wiki/Q205034","display_name":"Perpendicular","level":2,"score":0.5747966766357422},{"id":"https://openalex.org/C2778894819","wikidata":"https://www.wikidata.org/wiki/Q922718","display_name":"Sulfonate","level":3,"score":0.5599932670593262},{"id":"https://openalex.org/C2778665636","wikidata":"https://www.wikidata.org/wiki/Q412967","display_name":"Nafion","level":4,"score":0.5374062657356262},{"id":"https://openalex.org/C184651966","wikidata":"https://www.wikidata.org/wiki/Q906356","display_name":"Aqueous solution","level":2,"score":0.513694167137146},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.4766048789024353},{"id":"https://openalex.org/C112887158","wikidata":"https://www.wikidata.org/wiki/Q169324","display_name":"Hydrogen bond","level":3,"score":0.42629244923591614},{"id":"https://openalex.org/C113740112","wikidata":"https://www.wikidata.org/wiki/Q5904738","display_name":"Slab","level":2,"score":0.41170066595077515},{"id":"https://openalex.org/C168900304","wikidata":"https://www.wikidata.org/wiki/Q171407","display_name":"Valence (chemistry)","level":2,"score":0.4107525944709778},{"id":"https://openalex.org/C192562407","wikidata":"https://www.wikidata.org/wiki/Q228736","display_name":"Materials science","level":0,"score":0.36908188462257385},{"id":"https://openalex.org/C147597530","wikidata":"https://www.wikidata.org/wiki/Q369472","display_name":"Computational chemistry","level":1,"score":0.35215869545936584},{"id":"https://openalex.org/C41625074","wikidata":"https://www.wikidata.org/wiki/Q176088","display_name":"Membrane","level":2,"score":0.33051785826683044},{"id":"https://openalex.org/C32909587","wikidata":"https://www.wikidata.org/wiki/Q11369","display_name":"Molecule","level":2,"score":0.21275806427001953},{"id":"https://openalex.org/C147789679","wikidata":"https://www.wikidata.org/wiki/Q11372","display_name":"Physical chemistry","level":1,"score":0.19132354855537415},{"id":"https://openalex.org/C2524010","wikidata":"https://www.wikidata.org/wiki/Q8087","display_name":"Geometry","level":1,"score":0.18674233555793762},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.17390838265419006},{"id":"https://openalex.org/C52859227","wikidata":"https://www.wikidata.org/wiki/Q7877","display_name":"Electrochemistry","level":3,"score":0.13391205668449402},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.10878592729568481},{"id":"https://openalex.org/C537181965","wikidata":"https://www.wikidata.org/wiki/Q658","display_name":"Sodium","level":2,"score":0.0},{"id":"https://openalex.org/C62520636","wikidata":"https://www.wikidata.org/wiki/Q944","display_name":"Quantum mechanics","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/C8058405","wikidata":"https://www.wikidata.org/wiki/Q46255","display_name":"Geophysics","level":1,"score":0.0},{"id":"https://openalex.org/C17525397","wikidata":"https://www.wikidata.org/wiki/Q176140","display_name":"Electrode","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.molliq.2006.08.015","doi":"https://doi.org/10.1016/j.molliq.2006.08.015","is_oa":false,"landing_page_url":"https://doi.org/10.1016/j.molliq.2006.08.015","pdf_url":null,"source":{"id":"https://openalex.org/S189140625","display_name":"Journal of Molecular Liquids","issn_l":"0167-7322","issn":["0167-7322","1873-3166"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","jufo-1","ki-jl-1","norway-1","poland-100","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":"Journal of Molecular Liquids","raw_type":"journal-article"},{"id":"pmh:oai:juser.fz-juelich.de:51254","doi":null,"is_oa":false,"landing_page_url":"http://juser.fz-juelich.de/search?p=id:%22PreJuSER-51254%22","pdf_url":null,"source":{"id":"https://openalex.org/S4306401090","display_name":"JuSER (Forschungszentrum J\u00fclich)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I171892758","host_organization_name":"Forschungszentrum J\u00fclich","host_organization_lineage":["https://openalex.org/I171892758"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"Journal of molecular liquids 129, 92 - 100 (2006). doi:10.1016/j.molliq.2006.08.015","raw_type":"info:eu-repo/semantics/article"}],"best_oa_location":null,"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":25,"referenced_works":["https://openalex.org/W1974334105","https://openalex.org/W1976394244","https://openalex.org/W1982884548","https://openalex.org/W1996926462","https://openalex.org/W1998246739","https://openalex.org/W1999502246","https://openalex.org/W2002015916","https://openalex.org/W2009592144","https://openalex.org/W2025346738","https://openalex.org/W2035266068","https://openalex.org/W2039366080","https://openalex.org/W2043068789","https://openalex.org/W2049475242","https://openalex.org/W2070855066","https://openalex.org/W2073518966","https://openalex.org/W2092801384","https://openalex.org/W2106810694","https://openalex.org/W2124259384","https://openalex.org/W2127173085","https://openalex.org/W2143443629","https://openalex.org/W2145031930","https://openalex.org/W2159726220","https://openalex.org/W2169398350","https://openalex.org/W2318235115","https://openalex.org/W2950284345"],"related_works":["https://openalex.org/W6992762258","https://openalex.org/W68025725","https://openalex.org/W7000115753","https://openalex.org/W2318348044","https://openalex.org/W7055425262","https://openalex.org/W7151579227","https://openalex.org/W2009592144","https://openalex.org/W1436918783","https://openalex.org/W1982884548","https://openalex.org/W2021850817"],"abstract_inverted_index":null,"counts_by_year":[{"year":2026,"cited_by_count":1},{"year":2025,"cited_by_count":1},{"year":2023,"cited_by_count":1},{"year":2022,"cited_by_count":1},{"year":2021,"cited_by_count":1},{"year":2019,"cited_by_count":3},{"year":2018,"cited_by_count":2},{"year":2017,"cited_by_count":2},{"year":2016,"cited_by_count":1},{"year":2015,"cited_by_count":3},{"year":2014,"cited_by_count":2},{"year":2013,"cited_by_count":3},{"year":2012,"cited_by_count":2}],"updated_date":"2026-11-07T11:25:07.637180","created_date":"2016-06-24T00:00:00"}
