{"id":"https://openalex.org/W2013155703","doi":"https://doi.org/10.1063/1.459516","title":"Layering transitions in cylindrical pores","display_name":"Layering transitions in cylindrical pores","publication_year":1990,"publication_date":"1990-07-01","ids":{"openalex":"https://openalex.org/W2013155703","doi":"https://doi.org/10.1063/1.459516","mag":"2013155703"},"language":"en","primary_location":{"id":"doi:10.1063/1.459516","doi":"https://doi.org/10.1063/1.459516","is_oa":false,"landing_page_url":"https://doi.org/10.1063/1.459516","pdf_url":null,"source":{"id":"https://openalex.org/S77047749","display_name":"The Journal of Chemical Physics","issn_l":"0021-9606","issn":["0021-9606","1089-7690","1520-9032"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["anvur-scientific","cwts-core","dongbi-b","jufo-1","ki-jl-1","medline","norway-1","poland-100","russia-white-list-2","vabb-shw"],"host_organization":"https://openalex.org/P4310320257","host_organization_name":"American Institute of Physics","host_organization_lineage":["https://openalex.org/P4310320257"],"host_organization_lineage_names":["American Institute of Physics"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"The Journal of Chemical Physics","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/A5072538943","display_name":"Brian K. Peterson","orcid":"https://orcid.org/0000-0001-9147-3433","observed_orcids":["https://orcid.org/0000-0001-9147-3433"]},"institutions":[{"id":"https://openalex.org/I40120149","display_name":"University of Oxford","ror":"https://ror.org/052gg0110","country_code":"GB","type":"education","lineage":["https://openalex.org/I40120149"]}],"countries":["GB"],"is_corresponding":false,"raw_author_name":"Brian K. Peterson","raw_affiliation_strings":["Chemical Crystallography Laboratory, 9 Parks Road, Oxford OX1 3PD, England"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Chemical Crystallography Laboratory, 9 Parks Road, Oxford OX1 3PD, England","institution_ids":["https://openalex.org/I40120149"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5060340489","display_name":"Grant S. Heffelfinger","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I205783295","display_name":"Cornell University","ror":"https://ror.org/05bnh6r87","country_code":"US","type":"education","lineage":["https://openalex.org/I205783295"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Grant S. Heffelfinger","raw_affiliation_strings":["School of Chemical Engineering, Cornell University, Ithaca, New York 14853"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"School of Chemical Engineering, Cornell University, Ithaca, New York 14853","institution_ids":["https://openalex.org/I205783295"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5055124393","display_name":"Keith E. Gubbins","orcid":"https://orcid.org/0000-0003-0546-080X","observed_orcids":["https://orcid.org/0000-0003-0546-080X","https://orcid.org/0000-0001-6760-5897"]},"institutions":[{"id":"https://openalex.org/I205783295","display_name":"Cornell University","ror":"https://ror.org/05bnh6r87","country_code":"US","type":"education","lineage":["https://openalex.org/I205783295"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Keith E. Gubbins","raw_affiliation_strings":["School of Chemical Engineering, Cornell University, Ithaca, New York 14853"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"School of Chemical Engineering, Cornell University, Ithaca, New York 14853","institution_ids":["https://openalex.org/I205783295"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5050392058","display_name":"Frank van Swol","orcid":"https://orcid.org/0000-0003-0895-4493","observed_orcids":["https://orcid.org/0000-0003-0895-4493"]},"institutions":[{"id":"https://openalex.org/I157725225","display_name":"University of Illinois Urbana-Champaign","ror":"https://ror.org/047426m28","country_code":"US","type":"education","lineage":["https://openalex.org/I157725225"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Frank van Swol","raw_affiliation_strings":["Department of Chemical Engineering, University of Illinois, Urbana, Illinois 61801"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemical Engineering, University of Illinois, Urbana, Illinois 61801","institution_ids":["https://openalex.org/I157725225"]}]}],"institutions":[],"countries_distinct_count":2,"institutions_distinct_count":3,"corresponding_author_ids":[],"corresponding_institution_ids":[],"apc_list":{"value":3500,"currency":"USD","value_usd":3500},"apc_paid":null,"fwci":3.3918,"has_fulltext":false,"cited_by_count":71,"citation_normalized_percentile":{"value":0.92780978,"is_in_top_1_percent":false,"is_in_top_10_percent":true},"cited_by_percentile_year":{"min":88,"max":96},"biblio":{"volume":"93","issue":"1","first_page":"679","last_page":"685"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T13604","display_name":"Adsorption, diffusion, and thermodynamic properties of materials","score":0.6445000171661377,"subfield":{"id":"https://openalex.org/subfields/1606","display_name":"Physical and Theoretical Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T13604","display_name":"Adsorption, diffusion, and thermodynamic properties of materials","score":0.6445000171661377,"subfield":{"id":"https://openalex.org/subfields/1606","display_name":"Physical and Theoretical Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T10402","display_name":"Phase Equilibria and Thermodynamics","score":0.16249999403953552,"subfield":{"id":"https://openalex.org/subfields/1606","display_name":"Physical and Theoretical Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T10591","display_name":"Theoretical and Computational Physics","score":0.09669999778270721,"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"}}],"keywords":[{"id":"https://openalex.org/keywords/layering-transitions","display_name":"layering transitions","score":0.9779999852180481},{"id":"https://openalex.org/keywords/cylindrical-pores","display_name":"cylindrical pores","score":0.9649999737739563},{"id":"https://openalex.org/keywords/capillary-condensation","display_name":"capillary condensation","score":0.902999997138977},{"id":"https://openalex.org/keywords/adsorption-isotherms","display_name":"adsorption isotherms","score":0.9319999814033508},{"id":"https://openalex.org/keywords/fluid-wall-interaction","display_name":"fluid-wall interaction","score":0.8690000176429749},{"id":"https://openalex.org/keywords/first-order-phase-transition","display_name":"first-order phase transition","score":0.7139999866485596},{"id":"https://openalex.org/keywords/confined-fluids","display_name":"confined fluids","score":0.5550000071525574},{"id":"https://openalex.org/keywords/nonlocal-density-functional-theory","display_name":"nonlocal density functional theory","score":0.7310000061988831}],"concepts":[{"id":"https://openalex.org/C176055353","wikidata":"https://www.wikidata.org/wiki/Q1402114","display_name":"Layering","level":2,"score":0.9860246181488037},{"id":"https://openalex.org/C84351421","wikidata":"https://www.wikidata.org/wiki/Q2601751","display_name":"Capillary condensation","level":3,"score":0.7476990818977356},{"id":"https://openalex.org/C118419359","wikidata":"https://www.wikidata.org/wiki/Q682585","display_name":"Supercritical fluid","level":2,"score":0.564942479133606},{"id":"https://openalex.org/C196298200","wikidata":"https://www.wikidata.org/wiki/Q577705","display_name":"Critical point (mathematics)","level":2,"score":0.5243282914161682},{"id":"https://openalex.org/C168907044","wikidata":"https://www.wikidata.org/wiki/Q7834431","display_name":"Transition point","level":2,"score":0.4944877624511719},{"id":"https://openalex.org/C58070368","wikidata":"https://www.wikidata.org/wiki/Q106410","display_name":"Triple point","level":2,"score":0.4668448865413666},{"id":"https://openalex.org/C192562407","wikidata":"https://www.wikidata.org/wiki/Q228736","display_name":"Materials science","level":0,"score":0.4631959795951843},{"id":"https://openalex.org/C19499675","wikidata":"https://www.wikidata.org/wiki/Q232207","display_name":"Monte Carlo method","level":2,"score":0.44900307059288025},{"id":"https://openalex.org/C178635117","wikidata":"https://www.wikidata.org/wiki/Q747499","display_name":"RADIUS","level":2,"score":0.4351728558540344},{"id":"https://openalex.org/C150394285","wikidata":"https://www.wikidata.org/wiki/Q180254","display_name":"Adsorption","level":2,"score":0.40419691801071167},{"id":"https://openalex.org/C159467904","wikidata":"https://www.wikidata.org/wiki/Q2001702","display_name":"Chemical physics","level":1,"score":0.36467814445495605},{"id":"https://openalex.org/C97355855","wikidata":"https://www.wikidata.org/wiki/Q11473","display_name":"Thermodynamics","level":1,"score":0.3326435685157776},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.2967897653579712},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.2125226855278015},{"id":"https://openalex.org/C2524010","wikidata":"https://www.wikidata.org/wiki/Q8087","display_name":"Geometry","level":1,"score":0.14431598782539368},{"id":"https://openalex.org/C147789679","wikidata":"https://www.wikidata.org/wiki/Q11372","display_name":"Physical chemistry","level":1,"score":0.07935526967048645},{"id":"https://openalex.org/C105795698","wikidata":"https://www.wikidata.org/wiki/Q12483","display_name":"Statistics","level":1,"score":0.0},{"id":"https://openalex.org/C86803240","wikidata":"https://www.wikidata.org/wiki/Q420","display_name":"Biology","level":0,"score":0.0},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.0},{"id":"https://openalex.org/C59822182","wikidata":"https://www.wikidata.org/wiki/Q441","display_name":"Botany","level":1,"score":0.0},{"id":"https://openalex.org/C38652104","wikidata":"https://www.wikidata.org/wiki/Q3510521","display_name":"Computer security","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}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1063/1.459516","doi":"https://doi.org/10.1063/1.459516","is_oa":false,"landing_page_url":"https://doi.org/10.1063/1.459516","pdf_url":null,"source":{"id":"https://openalex.org/S77047749","display_name":"The Journal of Chemical Physics","issn_l":"0021-9606","issn":["0021-9606","1089-7690","1520-9032"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["anvur-scientific","cwts-core","dongbi-b","jufo-1","ki-jl-1","medline","norway-1","poland-100","russia-white-list-2","vabb-shw"],"host_organization":"https://openalex.org/P4310320257","host_organization_name":"American Institute of Physics","host_organization_lineage":["https://openalex.org/P4310320257"],"host_organization_lineage_names":["American Institute of Physics"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"The Journal of Chemical Physics","raw_type":"journal-article"}],"best_oa_location":null,"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[{"id":"https://openalex.org/F4320306076","display_name":"National Science Foundation","ror":"https://ror.org/021nxhr62"}],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":24,"referenced_works":["https://openalex.org/W626370501","https://openalex.org/W652920205","https://openalex.org/W1532304699","https://openalex.org/W1845618662","https://openalex.org/W1968167431","https://openalex.org/W1971556338","https://openalex.org/W1979277675","https://openalex.org/W1985941941","https://openalex.org/W2002118881","https://openalex.org/W2006755239","https://openalex.org/W2010538207","https://openalex.org/W2011020653","https://openalex.org/W2021374437","https://openalex.org/W2037914696","https://openalex.org/W2043070916","https://openalex.org/W2050936376","https://openalex.org/W2084872518","https://openalex.org/W2089722695","https://openalex.org/W2105800319","https://openalex.org/W2145347951","https://openalex.org/W2147653993","https://openalex.org/W2149866665","https://openalex.org/W2154961463","https://openalex.org/W2313683745"],"related_works":["https://openalex.org/W1979277675","https://openalex.org/W2078957493","https://openalex.org/W2154961463","https://openalex.org/W239064606","https://openalex.org/W2093250312","https://openalex.org/W2068179548","https://openalex.org/W1972333941","https://openalex.org/W136682654","https://openalex.org/W2079440492","https://openalex.org/W1982994182"],"abstract_inverted_index":{"We":[0],"report":[1],"grand":[2],"canonical":[3],"Monte":[4],"Carlo":[5],"simulations":[6],"and":[7,38],"nonlocal":[8],"density":[9],"functional":[10],"theory":[11],"results":[12],"for":[13,98,126,139,145],"layering":[14,54,65,75,92,123,154],"transitions":[15,55,93],"that":[16,144],"take":[17],"place":[18],"in":[19,57,66],"a":[20,29,32,39,99,112,115],"smooth":[21],"cylindrical":[22],"pore":[23,30],"with":[24,31,71,152],"strong":[25],"fluid\u2013wall":[26],"interactions.":[27],"For":[28],"radius":[33],"of":[34,62],"seven":[35],"molecular":[36],"diameters":[37],"temperature":[40,47,150],"below":[41],"the":[42,48,63,67,74,79,91,107,121,131,148,159],"bulk":[43,132,160],"fluid":[44],"triple":[45,133,161],"point":[46,134,162],"adsorption":[49,128],"isotherms":[50],"exhibit":[51],"three":[52],"distinct":[53],"ending":[56],"capillary":[58],"condensation.":[59],"The":[60],"growth":[61],"first":[64,108],"simulation":[68],"appears":[69],"supercritical":[70],"respect":[72],"to":[73,83,90,114,120],"critical":[76,149],"point,":[77],"but":[78],"subsequent":[80],"layers":[81],"appear":[82],"be":[84],"true":[85],"(first-order)":[86],"transitions.":[87],"In":[88],"addition":[89],"we":[94,105],"also":[95],"present":[96],"evidence":[97,138],"quasi-two-dimensional":[100],"freezing":[101],"transition.":[102,124],"That":[103],"is,":[104],"observed":[106],"adsorbed":[109],"layer":[110],"undergo":[111],"transition":[113,155],"frustrated":[116],"crystalline":[117],"state":[118],"prior":[119],"next":[122],"Finally,":[125],"an":[127],"isotherm":[129],"at":[130],"there":[135],"is":[136],"no":[137],"any":[140],"first-order":[141],"transitions,":[142],"indicating":[143],"our":[146],"system":[147],"associated":[151],"each":[153],"does":[156],"not":[157],"exceed":[158],"temperature.":[163]},"counts_by_year":[{"year":2021,"cited_by_count":2},{"year":2019,"cited_by_count":1},{"year":2018,"cited_by_count":2},{"year":2017,"cited_by_count":2},{"year":2015,"cited_by_count":1},{"year":2014,"cited_by_count":2}],"updated_date":"2026-11-04T10:54:05.112534","created_date":"2016-06-24T00:00:00"}