{"id":"https://openalex.org/W4388735375","doi":"https://doi.org/10.1021/acs.jpcb.3c04118","title":"Theoretical Examination of the Hydroxide Transport in Cobaltocenium-Containing Polyelectrolytes","display_name":"Theoretical Examination of the Hydroxide Transport in Cobaltocenium-Containing Polyelectrolytes","publication_year":2023,"publication_date":"2023-11-16","ids":{"openalex":"https://openalex.org/W4388735375","doi":"https://doi.org/10.1021/acs.jpcb.3c04118","pmid":"https://pubmed.ncbi.nlm.nih.gov/37972315"},"language":"en","primary_location":{"id":"doi:10.1021/acs.jpcb.3c04118","doi":"https://doi.org/10.1021/acs.jpcb.3c04118","is_oa":false,"landing_page_url":"https://doi.org/10.1021/acs.jpcb.3c04118","pdf_url":null,"source":{"id":"https://openalex.org/S185621672","display_name":"The Journal of Physical Chemistry B","issn_l":"1520-5207","issn":["1520-5207","1520-6106"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["anvur-scientific","cwts-core","dongbi-c","jufo-1","ki-jl-1","medline","norway-1","poland-140","russia-white-list-2","vabb-shw"],"host_organization":"https://openalex.org/P4310320006","host_organization_name":"American Chemical Society","host_organization_lineage":["https://openalex.org/P4310320006"],"host_organization_lineage_names":["American Chemical Society"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"The Journal of Physical Chemistry B","raw_type":"journal-article"},"volume":null,"type":"article","indexed_in":["crossref","pubmed"],"open_access":{"is_oa":true,"oa_status":"green","oa_url":"https://www.osti.gov/servlets/purl/2234363","any_repository_has_fulltext":true},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5030216281","display_name":"Sachith Wickramasinghe","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I155781252","display_name":"University of South Carolina","ror":"https://ror.org/02b6qw903","country_code":"US","type":"education","lineage":["https://openalex.org/I155781252"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Sachith Wickramasinghe","raw_affiliation_strings":["Department of Chemistry & Biochemistry, University of South Carolina, Columbia, South Carolina 29208, United States"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry & Biochemistry, University of South Carolina, Columbia, South Carolina 29208, United States","institution_ids":["https://openalex.org/I155781252"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5070895468","display_name":"Alexandria Hoehn","orcid":"https://orcid.org/0000-0001-8170-0532","observed_orcids":["https://orcid.org/0000-0001-8170-0532"]},"institutions":[{"id":"https://openalex.org/I155781252","display_name":"University of South Carolina","ror":"https://ror.org/02b6qw903","country_code":"US","type":"education","lineage":["https://openalex.org/I155781252"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Alexandria Hoehn","raw_affiliation_strings":["Department of Chemistry & Biochemistry, University of South Carolina, Columbia, South Carolina 29208, United States"],"raw_orcid":"https://orcid.org/0000-0001-8170-0532","affiliations":[{"raw_affiliation_string":"Department of Chemistry & Biochemistry, University of South Carolina, Columbia, South Carolina 29208, United States","institution_ids":["https://openalex.org/I155781252"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5089690112","display_name":"Shehani T. Wetthasinghe","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I155781252","display_name":"University of South Carolina","ror":"https://ror.org/02b6qw903","country_code":"US","type":"education","lineage":["https://openalex.org/I155781252"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Shehani T. Wetthasinghe","raw_affiliation_strings":["Department of Chemistry & Biochemistry, University of South Carolina, Columbia, South Carolina 29208, United States"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry & Biochemistry, University of South Carolina, Columbia, South Carolina 29208, United States","institution_ids":["https://openalex.org/I155781252"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5005216080","display_name":"Huina Lin","orcid":"https://orcid.org/0000-0002-7379-5313","observed_orcids":["https://orcid.org/0000-0002-7379-5313"]},"institutions":[{"id":"https://openalex.org/I155781252","display_name":"University of South Carolina","ror":"https://ror.org/02b6qw903","country_code":"US","type":"education","lineage":["https://openalex.org/I155781252"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Huina Lin","raw_affiliation_strings":["Department of Chemistry & Biochemistry, University of South Carolina, Columbia, South Carolina 29208, United States"],"raw_orcid":"https://orcid.org/0000-0002-7379-5313","affiliations":[{"raw_affiliation_string":"Department of Chemistry & Biochemistry, University of South Carolina, Columbia, South Carolina 29208, United States","institution_ids":["https://openalex.org/I155781252"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5035473719","display_name":"Qi Wang","orcid":"https://orcid.org/0000-0001-9928-2703","observed_orcids":["https://orcid.org/0000-0001-9928-2703","https://orcid.org/0000-0003-3418-8809","https://orcid.org/0000-0002-0501-1599","https://orcid.org/0000-0002-1328-8571"]},"institutions":[{"id":"https://openalex.org/I155781252","display_name":"University of South Carolina","ror":"https://ror.org/02b6qw903","country_code":"US","type":"education","lineage":["https://openalex.org/I155781252"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Qi Wang","raw_affiliation_strings":["Department of Mathematics, University of South Carolina, Columbia, South Carolina 29208, United States"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Mathematics, University of South Carolina, Columbia, South Carolina 29208, United States","institution_ids":["https://openalex.org/I155781252"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5039051768","display_name":"Jacek Jakowski","orcid":"https://orcid.org/0000-0003-4906-3574","observed_orcids":["https://orcid.org/0000-0003-4906-3574"]},"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"]},{"id":"https://openalex.org/I4390039300","display_name":"Center for Nanophase Materials Sciences","ror":"https://ror.org/01wass480","country_code":"US","type":"facility","lineage":["https://openalex.org/I1289243028","https://openalex.org/I1330989302","https://openalex.org/I39565521","https://openalex.org/I4210159294","https://openalex.org/I4390039300"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Jacek Jakowski","raw_affiliation_strings":["Center for Nanophase Materials Science, Oak Ridge National Laboratory, Oak Ridge, Tennessee 37830, United States"],"raw_orcid":"https://orcid.org/0000-0003-4906-3574","affiliations":[{"raw_affiliation_string":"Center for Nanophase Materials Science, Oak Ridge National Laboratory, Oak Ridge, Tennessee 37830, United States","institution_ids":["https://openalex.org/I1289243028","https://openalex.org/I4390039300"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5033284516","display_name":"Vitaly A. Rassolov","orcid":"https://orcid.org/0000-0002-7244-8870","observed_orcids":["https://orcid.org/0000-0002-7244-8870"]},"institutions":[{"id":"https://openalex.org/I155781252","display_name":"University of South Carolina","ror":"https://ror.org/02b6qw903","country_code":"US","type":"education","lineage":["https://openalex.org/I155781252"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Vitaly Rassolov","raw_affiliation_strings":["Department of Chemistry & Biochemistry, University of South Carolina, Columbia, South Carolina 29208, United States"],"raw_orcid":"https://orcid.org/0000-0002-7244-8870","affiliations":[{"raw_affiliation_string":"Department of Chemistry & Biochemistry, University of South Carolina, Columbia, South Carolina 29208, United States","institution_ids":["https://openalex.org/I155781252"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5082199982","display_name":"Chuanbing Tang","orcid":"https://orcid.org/0000-0002-0242-8241","observed_orcids":["https://orcid.org/0000-0002-0242-8241"]},"institutions":[{"id":"https://openalex.org/I155781252","display_name":"University of South Carolina","ror":"https://ror.org/02b6qw903","country_code":"US","type":"education","lineage":["https://openalex.org/I155781252"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Chuanbing Tang","raw_affiliation_strings":["Department of Chemistry & Biochemistry, University of South Carolina, Columbia, South Carolina 29208, United States"],"raw_orcid":"https://orcid.org/0000-0002-0242-8241","affiliations":[{"raw_affiliation_string":"Department of Chemistry & Biochemistry, University of South Carolina, Columbia, South Carolina 29208, United States","institution_ids":["https://openalex.org/I155781252"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5018769135","display_name":"Sophya V. Garashchuk","orcid":"https://orcid.org/0000-0003-2452-7379","observed_orcids":["https://orcid.org/0000-0003-2452-7379"]},"institutions":[{"id":"https://openalex.org/I155781252","display_name":"University of South Carolina","ror":"https://ror.org/02b6qw903","country_code":"US","type":"education","lineage":["https://openalex.org/I155781252"]}],"countries":["US"],"is_corresponding":true,"raw_author_name":"Sophya Garashchuk","raw_affiliation_strings":["Department of Chemistry & Biochemistry, University of South Carolina, Columbia, South Carolina 29208, United States"],"raw_orcid":"https://orcid.org/0000-0003-2452-7379","affiliations":[{"raw_affiliation_string":"Department of Chemistry & Biochemistry, University of South Carolina, Columbia, South Carolina 29208, United States","institution_ids":["https://openalex.org/I155781252"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":3,"corresponding_author_ids":["https://openalex.org/A5018769135"],"corresponding_institution_ids":["https://openalex.org/I155781252"],"apc_list":null,"apc_paid":null,"fwci":0.3718,"has_fulltext":true,"cited_by_count":5,"citation_normalized_percentile":{"value":0.50168665,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":89,"max":98},"biblio":{"volume":"127","issue":"47","first_page":"10129","last_page":"10141"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10409","display_name":"Fuel Cells and Related Materials","score":0.9140999913215637,"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":0.9140999913215637,"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":0.05009999871253967,"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/T11690","display_name":"Advanced battery technologies research","score":0.00800000037997961,"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"}}],"keywords":[{"id":"https://openalex.org/keywords/hydroxide-transport","display_name":"hydroxide transport","score":0.777999997138977},{"id":"https://openalex.org/keywords/cobaltocenium","display_name":"cobaltocenium","score":0.9089999794960022},{"id":"https://openalex.org/keywords/polyelectrolytes","display_name":"polyelectrolytes","score":0.9039999842643738},{"id":"https://openalex.org/keywords/anion-exchange-membranes","display_name":"anion exchange membranes","score":0.9959999918937683},{"id":"https://openalex.org/keywords/proton-hopping","display_name":"proton hopping","score":0.5220000147819519},{"id":"https://openalex.org/keywords/grotthuss-mechanism","display_name":"Grotthuss mechanism","score":0.9599999785423279},{"id":"https://openalex.org/keywords/solvation-shell","display_name":"solvation shell","score":0.8059999942779541},{"id":"https://openalex.org/keywords/electrostatic-interactions","display_name":"electrostatic interactions","score":0.8560000061988831},{"id":"https://openalex.org/keywords/water-density","display_name":"water density","score":0.6510000228881836},{"id":"https://openalex.org/keywords/density-functional-tight-binding","display_name":"density functional tight binding","score":0.6769999861717224},{"id":"https://openalex.org/keywords/nuclear-quantum-effects","display_name":"nuclear quantum effects","score":0.7699999809265137},{"id":"https://openalex.org/keywords/confined-channels","display_name":"confined channels","score":0.421999990940094},{"id":"https://openalex.org/keywords/ionic-conductivity","display_name":"ionic conductivity","score":0.5889999866485596}],"concepts":[{"id":"https://openalex.org/C2775896084","wikidata":"https://www.wikidata.org/wiki/Q425597","display_name":"Hydroxide","level":2,"score":0.7492666244506836},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.7289448976516724},{"id":"https://openalex.org/C149823470","wikidata":"https://www.wikidata.org/wiki/Q1088326","display_name":"Solvation shell","level":4,"score":0.7160090208053589},{"id":"https://openalex.org/C69357855","wikidata":"https://www.wikidata.org/wiki/Q163214","display_name":"Diffusion","level":2,"score":0.686603844165802},{"id":"https://openalex.org/C148093993","wikidata":"https://www.wikidata.org/wiki/Q739398","display_name":"Solvation","level":3,"score":0.6678302884101868},{"id":"https://openalex.org/C159467904","wikidata":"https://www.wikidata.org/wiki/Q2001702","display_name":"Chemical physics","level":1,"score":0.5982459783554077},{"id":"https://openalex.org/C184651966","wikidata":"https://www.wikidata.org/wiki/Q906356","display_name":"Aqueous solution","level":2,"score":0.5286182761192322},{"id":"https://openalex.org/C145148216","wikidata":"https://www.wikidata.org/wiki/Q36496","display_name":"Ion","level":2,"score":0.5098706483840942},{"id":"https://openalex.org/C117626034","wikidata":"https://www.wikidata.org/wiki/Q26336","display_name":"Electrostatics","level":2,"score":0.48466211557388306},{"id":"https://openalex.org/C2182769","wikidata":"https://www.wikidata.org/wiki/Q62500","display_name":"Ionic bonding","level":3,"score":0.46681496500968933},{"id":"https://openalex.org/C54516573","wikidata":"https://www.wikidata.org/wiki/Q2294","display_name":"Proton","level":2,"score":0.4666310250759125},{"id":"https://openalex.org/C32909587","wikidata":"https://www.wikidata.org/wiki/Q11369","display_name":"Molecule","level":2,"score":0.4284725487232208},{"id":"https://openalex.org/C59593255","wikidata":"https://www.wikidata.org/wiki/Q901663","display_name":"Molecular dynamics","level":2,"score":0.4198177456855774},{"id":"https://openalex.org/C41625074","wikidata":"https://www.wikidata.org/wiki/Q176088","display_name":"Membrane","level":2,"score":0.41112565994262695},{"id":"https://openalex.org/C147597530","wikidata":"https://www.wikidata.org/wiki/Q369472","display_name":"Computational chemistry","level":1,"score":0.34525078535079956},{"id":"https://openalex.org/C179104552","wikidata":"https://www.wikidata.org/wiki/Q11165","display_name":"Inorganic chemistry","level":1,"score":0.3099898099899292},{"id":"https://openalex.org/C147789679","wikidata":"https://www.wikidata.org/wiki/Q11372","display_name":"Physical chemistry","level":1,"score":0.28287187218666077},{"id":"https://openalex.org/C97355855","wikidata":"https://www.wikidata.org/wiki/Q11473","display_name":"Thermodynamics","level":1,"score":0.2012828290462494},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.11001452803611755},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.06772062182426453},{"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/C55493867","wikidata":"https://www.wikidata.org/wiki/Q7094","display_name":"Biochemistry","level":1,"score":0.0}],"mesh":[],"locations_count":3,"locations":[{"id":"doi:10.1021/acs.jpcb.3c04118","doi":"https://doi.org/10.1021/acs.jpcb.3c04118","is_oa":false,"landing_page_url":"https://doi.org/10.1021/acs.jpcb.3c04118","pdf_url":null,"source":{"id":"https://openalex.org/S185621672","display_name":"The Journal of Physical Chemistry B","issn_l":"1520-5207","issn":["1520-5207","1520-6106"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["anvur-scientific","cwts-core","dongbi-c","jufo-1","ki-jl-1","medline","norway-1","poland-140","russia-white-list-2","vabb-shw"],"host_organization":"https://openalex.org/P4310320006","host_organization_name":"American Chemical Society","host_organization_lineage":["https://openalex.org/P4310320006"],"host_organization_lineage_names":["American Chemical Society"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"The Journal of Physical Chemistry B","raw_type":"journal-article"},{"id":"pmid:37972315","doi":null,"is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/37972315","pdf_url":null,"source":{"id":"https://openalex.org/S4306525036","display_name":"PubMed","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I1299303238","host_organization_name":"National Institutes of Health","host_organization_lineage":["https://openalex.org/I1299303238"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"The journal of physical chemistry. B","raw_type":"Journal Article"},{"id":"pmh:oai:osti.gov:2234363","doi":null,"is_oa":true,"landing_page_url":"https://www.osti.gov/biblio/2234363","pdf_url":"https://www.osti.gov/servlets/purl/2234363","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":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"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":[],"type":"repository"},"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":null,"raw_type":null}],"best_oa_location":{"id":"pmh:oai:osti.gov:2234363","doi":null,"is_oa":true,"landing_page_url":"https://www.osti.gov/biblio/2234363","pdf_url":"https://www.osti.gov/servlets/purl/2234363","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":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"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":[],"type":"repository"},"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":null,"raw_type":null},"sustainable_development_goals":[],"study_designs":[],"awards":[{"id":"https://openalex.org/G2877922392","display_name":null,"funder_award_id":"CHE-1955768","funder_id":"https://openalex.org/F4320337393","funder_display_name":"Division of Chemistry"},{"id":"https://openalex.org/G3485851176","display_name":null,"funder_award_id":"DE-SC0020272","funder_id":"https://openalex.org/F4320337480","funder_display_name":"Basic Energy Sciences"},{"id":"https://openalex.org/G556956667","display_name":null,"funder_award_id":"OIA-1655740.","funder_id":"https://openalex.org/F4320337378","funder_display_name":"Office of Integrative Activities"},{"id":"https://openalex.org/G7350702806","display_name":null,"funder_award_id":"CHE-2308922","funder_id":"https://openalex.org/F4320337393","funder_display_name":"Division of Chemistry"}],"funders":[{"id":"https://openalex.org/F4320306084","display_name":"U.S. Department of Energy","ror":"https://ror.org/01bj3aw27"},{"id":"https://openalex.org/F4320319233","display_name":"South Carolina EPSCoR","ror":null},{"id":"https://openalex.org/F4320337378","display_name":"Office of Integrative Activities","ror":"https://ror.org/04k9mqs78"},{"id":"https://openalex.org/F4320337393","display_name":"Division of Chemistry","ror":"https://ror.org/01ar8dr59"},{"id":"https://openalex.org/F4320337480","display_name":"Basic Energy Sciences","ror":"https://ror.org/05mg91w61"}],"has_content":{"grobid_xml":true,"pdf":true},"content_urls":{"pdf":"https://content.openalex.org/works/W4388735375.pdf","grobid_xml":"https://content.openalex.org/works/W4388735375.grobid-xml"},"referenced_works_count":64,"referenced_works":["https://openalex.org/W1968166922","https://openalex.org/W1975056981","https://openalex.org/W1985761805","https://openalex.org/W1987959649","https://openalex.org/W1994611762","https://openalex.org/W2003534784","https://openalex.org/W2011159427","https://openalex.org/W2011533818","https://openalex.org/W2022696619","https://openalex.org/W2026172453","https://openalex.org/W2032222091","https://openalex.org/W2032247885","https://openalex.org/W2033336421","https://openalex.org/W2033339991","https://openalex.org/W2038090293","https://openalex.org/W2051831029","https://openalex.org/W2059838064","https://openalex.org/W2063079310","https://openalex.org/W2067140406","https://openalex.org/W2078184681","https://openalex.org/W2084628727","https://openalex.org/W2094616309","https://openalex.org/W2111218731","https://openalex.org/W2124164076","https://openalex.org/W2133832849","https://openalex.org/W2138305674","https://openalex.org/W2165501532","https://openalex.org/W2187235166","https://openalex.org/W2209511703","https://openalex.org/W2209596231","https://openalex.org/W2297568602","https://openalex.org/W2327518636","https://openalex.org/W2330988604","https://openalex.org/W2333630755","https://openalex.org/W2461808231","https://openalex.org/W2580352930","https://openalex.org/W2591951383","https://openalex.org/W2592884795","https://openalex.org/W2621202020","https://openalex.org/W2757351473","https://openalex.org/W2786419729","https://openalex.org/W2802624821","https://openalex.org/W2808079782","https://openalex.org/W2896522374","https://openalex.org/W2911156977","https://openalex.org/W2912006774","https://openalex.org/W2914212909","https://openalex.org/W2919492696","https://openalex.org/W2954757122","https://openalex.org/W2996591034","https://openalex.org/W3013002235","https://openalex.org/W3015406933","https://openalex.org/W3043255999","https://openalex.org/W3120073660","https://openalex.org/W3166627696","https://openalex.org/W3204132852","https://openalex.org/W3206966787","https://openalex.org/W4205318946","https://openalex.org/W4205923389","https://openalex.org/W4210419522","https://openalex.org/W4220899223","https://openalex.org/W4229013177","https://openalex.org/W4309214958","https://openalex.org/W4386530752"],"related_works":["https://openalex.org/W7140168186","https://openalex.org/W4402473125","https://openalex.org/W4386853137","https://openalex.org/W4394867397","https://openalex.org/W3024162566","https://openalex.org/W3034075132","https://openalex.org/W4409279993","https://openalex.org/W4288741103","https://openalex.org/W2209511703","https://openalex.org/W2912006774"],"abstract_inverted_index":{"Polymers":[0],"incorporating":[1],"cobaltocenium":[2,37,178],"groups":[3],"have":[4],"received":[5],"attention":[6],"as":[7],"promising":[8],"components":[9],"of":[10,18,36,48,94,142,177,186],"anion-exchange":[11],"membranes":[12],"(AEMs),":[13],"exhibiting":[14],"a":[15,121],"good":[16],"balance":[17],"chemical":[19,181],"stability":[20],"and":[21,102,113,183],"high":[22],"ionic":[23],"conductivity.":[24],"In":[25,60],"this":[26],"work,":[27],"we":[28],"analyze":[29],"the":[30,34,45,57,64,68,73,78,85,90,95,99,111,118,140,153,157,168,172,184],"hydroxide":[31,86],"diffusion":[32,87,107,115,126,130],"in":[33,39,52],"presence":[35],"cations":[38],"an":[40],"aqueous":[41],"environment":[42],"based":[43],"on":[44,89],"molecular":[46],"dynamics":[47],"model":[49],"systems":[50],"confined":[51],"one":[53],"dimension":[54],"to":[55,62,151],"mimic":[56],"AEM":[58],"channels.":[59],"order":[61],"describe":[63],"proton":[65,173],"hopping":[66],"mechanism,":[67],"forces":[69],"are":[70,147,190],"obtained":[71],"from":[72],"electronic":[74],"structure":[75],"computed":[76],"at":[77,124],"density-functional":[79],"tight-binding":[80],"level.":[81],"We":[82],"find":[83],"that":[84],"depends":[88],"channel":[91],"size,":[92],"modulation":[93],"electrostatic":[96,158],"interactions":[97],"by":[98],"solvation":[100,154],"shell,":[101,155],"its":[103],"rearrangement":[104],"ability.":[105],"Hydroxide":[106],"proceeds":[108],"via":[109],"both":[110],"vehicular":[112],"structural":[114],"mechanisms":[116],"with":[117],"latter":[119],"playing":[120],"larger":[122],"role":[123,185],"low":[125],"coefficients.":[127],"The":[128,175],"highest":[129],"coefficient":[131],"is":[132,164],"observed":[133],"under":[134],"moderate":[135],"water":[136,149,169],"densities":[137],"(around":[138],"half":[139],"density":[141],"liquid":[143],"water)":[144],"when":[145],"there":[146,163],"enough":[148,165],"molecules":[150],"form":[152],"reducing":[156],"interaction":[159],"between":[160],"ions,":[161],"yet":[162],"space":[166],"for":[167],"rearrangements":[170],"during":[171],"hopping.":[174],"effects":[176,189],"separation,":[179],"orientation,":[180],"modifications,":[182],"nuclear":[187],"quantum":[188],"also":[191],"discussed.":[192]},"counts_by_year":[{"year":2026,"cited_by_count":3},{"year":2025,"cited_by_count":1},{"year":2024,"cited_by_count":1}],"updated_date":"2026-10-27T15:51:10.671819","created_date":"2023-11-17T00:00:00"}
