{"id":"https://openalex.org/W2024923953","doi":"https://doi.org/10.1021/la960886d","title":"Interface between Monoclinic Crystalline Cellulose and Water: Breakdown of the Odd/Even Duplicity","display_name":"Interface between Monoclinic Crystalline Cellulose and Water: Breakdown of the Odd/Even Duplicity","publication_year":1997,"publication_date":"1997-02-01","ids":{"openalex":"https://openalex.org/W2024923953","doi":"https://doi.org/10.1021/la960886d","mag":"2024923953"},"language":"en","primary_location":{"id":"doi:10.1021/la960886d","doi":"https://doi.org/10.1021/la960886d","is_oa":false,"landing_page_url":"https://doi.org/10.1021/la960886d","pdf_url":null,"source":{"id":"https://openalex.org/S75741262","display_name":"Langmuir","issn_l":"0743-7463","issn":["0743-7463","1520-5827"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["anvur-scientific","cwts-core","dongbi-d","doyens","jufo-2","ki-jl-1","medline","norway-1","poland-100","russia-white-list-1","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":"Langmuir","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/A5110271762","display_name":"Andreas P. Heiner","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I87653560","display_name":"VTT Technical Research Centre of Finland","ror":"https://ror.org/04b181w54","country_code":"FI","type":"nonprofit","lineage":["https://openalex.org/I4210089493","https://openalex.org/I87653560"]}],"countries":["FI"],"is_corresponding":true,"raw_author_name":"Andreas P. Heiner","raw_affiliation_strings":["VTT Biotechnology and Food Research, POB 1500, FIN-02044 Espoo, Finland"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"VTT Biotechnology and Food Research, POB 1500, FIN-02044 Espoo, Finland","institution_ids":["https://openalex.org/I87653560"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5046099560","display_name":"Olle Teleman","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I87653560","display_name":"VTT Technical Research Centre of Finland","ror":"https://ror.org/04b181w54","country_code":"FI","type":"nonprofit","lineage":["https://openalex.org/I4210089493","https://openalex.org/I87653560"]}],"countries":["FI"],"is_corresponding":false,"raw_author_name":"Olle Teleman","raw_affiliation_strings":["VTT Biotechnology and Food Research, POB 1500, FIN-02044 Espoo, Finland"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"VTT Biotechnology and Food Research, POB 1500, FIN-02044 Espoo, Finland","institution_ids":["https://openalex.org/I87653560"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":1,"corresponding_author_ids":["https://openalex.org/A5110271762"],"corresponding_institution_ids":["https://openalex.org/I87653560"],"apc_list":{"value":4500,"currency":"USD","value_usd":4500},"apc_paid":null,"fwci":1.6583,"has_fulltext":false,"cited_by_count":94,"citation_normalized_percentile":{"value":0.77355316,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":93,"max":99},"biblio":{"volume":"13","issue":"3","first_page":"511","last_page":"518"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10610","display_name":"Advanced Cellulose Research Studies","score":0.98580002784729,"subfield":{"id":"https://openalex.org/subfields/2502","display_name":"Biomaterials"},"field":{"id":"https://openalex.org/fields/25","display_name":"Materials Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T10610","display_name":"Advanced Cellulose Research Studies","score":0.98580002784729,"subfield":{"id":"https://openalex.org/subfields/2502","display_name":"Biomaterials"},"field":{"id":"https://openalex.org/fields/25","display_name":"Materials Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T10869","display_name":"Polysaccharides and Plant Cell Walls","score":0.00839999970048666,"subfield":{"id":"https://openalex.org/subfields/1110","display_name":"Plant Science"},"field":{"id":"https://openalex.org/fields/11","display_name":"Agricultural and Biological Sciences"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}},{"id":"https://openalex.org/T14488","display_name":"Chemical and Physical Studies","score":0.0007999999797903001,"subfield":{"id":"https://openalex.org/subfields/1304","display_name":"Biophysics"},"field":{"id":"https://openalex.org/fields/13","display_name":"Biochemistry, Genetics and Molecular Biology"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/cellulose-ibeta","display_name":"cellulose I\u03b2","score":0.9789999723434448},{"id":"https://openalex.org/keywords/hydrogen-bonding","display_name":"hydrogen bonding","score":0.5770000219345093},{"id":"https://openalex.org/keywords/water-dynamics","display_name":"water dynamics","score":0.40700000524520874}],"concepts":[{"id":"https://openalex.org/C2779251873","wikidata":"https://www.wikidata.org/wiki/Q80294","display_name":"Cellulose","level":2,"score":0.813625156879425},{"id":"https://openalex.org/C112887158","wikidata":"https://www.wikidata.org/wiki/Q169324","display_name":"Hydrogen bond","level":3,"score":0.7588498592376709},{"id":"https://openalex.org/C61276311","wikidata":"https://www.wikidata.org/wiki/Q624543","display_name":"Monoclinic crystal system","level":3,"score":0.6972635984420776},{"id":"https://openalex.org/C8010536","wikidata":"https://www.wikidata.org/wiki/Q160398","display_name":"Crystallography","level":1,"score":0.6858983039855957},{"id":"https://openalex.org/C32909587","wikidata":"https://www.wikidata.org/wiki/Q11369","display_name":"Molecule","level":2,"score":0.6233912110328674},{"id":"https://openalex.org/C166950319","wikidata":"https://www.wikidata.org/wiki/Q245031","display_name":"Intermolecular force","level":3,"score":0.6013926267623901},{"id":"https://openalex.org/C59593255","wikidata":"https://www.wikidata.org/wiki/Q901663","display_name":"Molecular dynamics","level":2,"score":0.5586070418357849},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.5547184944152832},{"id":"https://openalex.org/C2781285689","wikidata":"https://www.wikidata.org/wiki/Q21921428","display_name":"Crystal (programming language)","level":2,"score":0.5418229699134827},{"id":"https://openalex.org/C159467904","wikidata":"https://www.wikidata.org/wiki/Q2001702","display_name":"Chemical physics","level":1,"score":0.43207791447639465},{"id":"https://openalex.org/C115624301","wikidata":"https://www.wikidata.org/wiki/Q895901","display_name":"Crystal structure","level":2,"score":0.4275580048561096},{"id":"https://openalex.org/C77557913","wikidata":"https://www.wikidata.org/wiki/Q864822","display_name":"Electron diffraction","level":3,"score":0.4180462062358856},{"id":"https://openalex.org/C207114421","wikidata":"https://www.wikidata.org/wiki/Q133900","display_name":"Diffraction","level":2,"score":0.35176563262939453},{"id":"https://openalex.org/C192562407","wikidata":"https://www.wikidata.org/wiki/Q228736","display_name":"Materials science","level":0,"score":0.3288905620574951},{"id":"https://openalex.org/C147597530","wikidata":"https://www.wikidata.org/wiki/Q369472","display_name":"Computational chemistry","level":1,"score":0.2484132945537567},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.16018185019493103},{"id":"https://openalex.org/C120665830","wikidata":"https://www.wikidata.org/wiki/Q14620","display_name":"Optics","level":1,"score":0.09167027473449707},{"id":"https://openalex.org/C199360897","wikidata":"https://www.wikidata.org/wiki/Q9143","display_name":"Programming language","level":1,"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/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1021/la960886d","doi":"https://doi.org/10.1021/la960886d","is_oa":false,"landing_page_url":"https://doi.org/10.1021/la960886d","pdf_url":null,"source":{"id":"https://openalex.org/S75741262","display_name":"Langmuir","issn_l":"0743-7463","issn":["0743-7463","1520-5827"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["anvur-scientific","cwts-core","dongbi-d","doyens","jufo-2","ki-jl-1","medline","norway-1","poland-100","russia-white-list-1","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":"Langmuir","raw_type":"journal-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":29,"referenced_works":["https://openalex.org/W1968936012","https://openalex.org/W1969878877","https://openalex.org/W1980220562","https://openalex.org/W1986471706","https://openalex.org/W1994725424","https://openalex.org/W1995107686","https://openalex.org/W1997146296","https://openalex.org/W1997270755","https://openalex.org/W2006138325","https://openalex.org/W2007458524","https://openalex.org/W2011090432","https://openalex.org/W2011152246","https://openalex.org/W2019652007","https://openalex.org/W2022187794","https://openalex.org/W2023097409","https://openalex.org/W2027267334","https://openalex.org/W2028605580","https://openalex.org/W2049475242","https://openalex.org/W2056640340","https://openalex.org/W2071756784","https://openalex.org/W2075970978","https://openalex.org/W2087249133","https://openalex.org/W2102112101","https://openalex.org/W2108293193","https://openalex.org/W2110424077","https://openalex.org/W2112396529","https://openalex.org/W2317861136","https://openalex.org/W3004670478","https://openalex.org/W4285719527"],"related_works":["https://openalex.org/W1982446437","https://openalex.org/W2041859784","https://openalex.org/W2770875699","https://openalex.org/W2731169554","https://openalex.org/W2725909720","https://openalex.org/W2080194348","https://openalex.org/W2000950212","https://openalex.org/W1976602895","https://openalex.org/W1979866376","https://openalex.org/W2921733394"],"abstract_inverted_index":{"The":[0,128,144],"interface":[1],"between":[2,96],"the":[3,43,46,50,60,70,75,94,104,108,111,126,135,159,163],"(110)":[4],"crystal":[5,61],"face":[6],"of":[7,55,74,93,110,122,131,162],"cellulose":[8,19,51,76,145],"I\u03b2":[9],"and":[10,36,57,98],"water":[11,90,132],"was":[12],"studied":[13],"by":[14,86,119,141],"molecular":[15],"dynamics":[16,58,116],"simulation":[17],"with":[18,89],"coordinates":[20],"refined":[21],"from":[22,59],"electron":[23],"diffraction":[24],"data":[25],"as":[26],"a":[27,120],"starting":[28],"point.":[29],"Potential":[30],"energies,":[31],"pucker":[32],"parameters,":[33],"torsion":[34],"angles,":[35],"hydrogen":[37,78,87],"bonding":[38,79],"have":[39],"been":[40],"used":[41],"for":[42,107,158],"characterization.":[44],"Only":[45],"topmost":[47],"layer":[48,138],"in":[49,53,134],"differs":[52],"terms":[54],"structure":[56],"bulk,":[62],"but":[63,82],"even":[64,97],"these":[65],"difference":[66,95],"are":[67],"small.":[68],"At":[69],"surface":[71,146],"approximately":[72],"half":[73],"intermolecular":[77],"is":[80,84,117,139],"lost,":[81],"this":[83],"compensated":[85],"bonds":[88],"molecules.":[91],"Much":[92],"odd":[99],"(200)":[100],"planes":[101],"disappears":[102],"at":[103],"interface,":[105],"except":[106],"orientation":[109],"glucose":[112],"ring":[113],"plane.":[114],"Water":[115],"retarded":[118],"factor":[121],"2\u22123":[123],"close":[124],"to":[125],"surface.":[127,164],"potential":[129],"energy":[130],"molecules":[133],"first":[136],"hydration":[137,161],"lower":[140],"2":[142],"kJ/mol.":[143],"contains":[147],"about":[148],"five":[149],"exposed":[150],"hydroxyl":[151],"groups":[152],"per":[153],"square":[154],"nanometer,":[155],"which":[156],"accounts":[157],"good":[160]},"counts_by_year":[{"year":2026,"cited_by_count":2},{"year":2024,"cited_by_count":4},{"year":2023,"cited_by_count":2},{"year":2022,"cited_by_count":4},{"year":2021,"cited_by_count":6},{"year":2020,"cited_by_count":3},{"year":2019,"cited_by_count":9},{"year":2018,"cited_by_count":5},{"year":2017,"cited_by_count":4},{"year":2016,"cited_by_count":2},{"year":2015,"cited_by_count":5},{"year":2014,"cited_by_count":3},{"year":2013,"cited_by_count":5},{"year":2012,"cited_by_count":8}],"updated_date":"2026-11-07T11:25:07.637180","created_date":"2016-06-24T00:00:00"}