{"id":"https://openalex.org/W4401431978","doi":"https://doi.org/10.1021/acs.jced.4c00273","title":"Solid\u2013Liquid Phase Equilibrium and Dissolution Properties of 1,3,5,7-Tetranitro-1,3,5,7-tetraazacyclooctane Form \u03b1 in Pure Organic Solvents","display_name":"Solid\u2013Liquid Phase Equilibrium and Dissolution Properties of 1,3,5,7-Tetranitro-1,3,5,7-tetraazacyclooctane Form \u03b1 in Pure Organic Solvents","publication_year":2024,"publication_date":"2024-08-08","ids":{"openalex":"https://openalex.org/W4401431978","doi":"https://doi.org/10.1021/acs.jced.4c00273"},"language":"en","primary_location":{"id":"doi:10.1021/acs.jced.4c00273","doi":"https://doi.org/10.1021/acs.jced.4c00273","is_oa":false,"landing_page_url":"https://doi.org/10.1021/acs.jced.4c00273","pdf_url":null,"source":{"id":"https://openalex.org/S204459408","display_name":"Journal of Chemical & Engineering Data","issn_l":"0021-9568","issn":["0021-9568","1520-5134"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-c","jufo-1","norway-1","poland-70","russia-white-list-2"],"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":"Journal of Chemical &amp; Engineering Data","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/A5046215256","display_name":"Yanfei Sun","orcid":"https://orcid.org/0000-0003-1947-9245","observed_orcids":["https://orcid.org/0000-0003-1947-9245"]},"institutions":[{"id":"https://openalex.org/I36399199","display_name":"Nanjing University of Science and Technology","ror":"https://ror.org/00xp9wg62","country_code":"CN","type":"education","lineage":["https://openalex.org/I36399199"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Yanfei Sun","raw_affiliation_strings":["School of Chemistry and Chemical Engineering, Nanjing University of Science and Technology, Nanjing 210094, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"School of Chemistry and Chemical Engineering, Nanjing University of Science and Technology, Nanjing 210094, China","institution_ids":["https://openalex.org/I36399199"]}]},{"author_position":"middle","author":{"id":null,"display_name":"Yuan Gao","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I36399199","display_name":"Nanjing University of Science and Technology","ror":"https://ror.org/00xp9wg62","country_code":"CN","type":"education","lineage":["https://openalex.org/I36399199"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Yuan Gao","raw_affiliation_strings":["School of Chemistry and Chemical Engineering, Nanjing University of Science and Technology, Nanjing 210094, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"School of Chemistry and Chemical Engineering, Nanjing University of Science and Technology, Nanjing 210094, China","institution_ids":["https://openalex.org/I36399199"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5104243076","display_name":"Ziping Yin","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I36399199","display_name":"Nanjing University of Science and Technology","ror":"https://ror.org/00xp9wg62","country_code":"CN","type":"education","lineage":["https://openalex.org/I36399199"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Ziping Yin","raw_affiliation_strings":["School of Chemistry and Chemical Engineering, Nanjing University of Science and Technology, Nanjing 210094, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"School of Chemistry and Chemical Engineering, Nanjing University of Science and Technology, Nanjing 210094, China","institution_ids":["https://openalex.org/I36399199"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5019869767","display_name":"Zuoxin Liu","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I36399199","display_name":"Nanjing University of Science and Technology","ror":"https://ror.org/00xp9wg62","country_code":"CN","type":"education","lineage":["https://openalex.org/I36399199"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Zuoxin Liu","raw_affiliation_strings":["School of Chemistry and Chemical Engineering, Nanjing University of Science and Technology, Nanjing 210094, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"School of Chemistry and Chemical Engineering, Nanjing University of Science and Technology, Nanjing 210094, China","institution_ids":["https://openalex.org/I36399199"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5059526048","display_name":"Xianxiong Chen","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I36399199","display_name":"Nanjing University of Science and Technology","ror":"https://ror.org/00xp9wg62","country_code":"CN","type":"education","lineage":["https://openalex.org/I36399199"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Xianxiong Chen","raw_affiliation_strings":["School of Chemistry and Chemical Engineering, Nanjing University of Science and Technology, Nanjing 210094, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"School of Chemistry and Chemical Engineering, Nanjing University of Science and Technology, Nanjing 210094, China","institution_ids":["https://openalex.org/I36399199"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5092090283","display_name":"Yu Zhang","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I36399199","display_name":"Nanjing University of Science and Technology","ror":"https://ror.org/00xp9wg62","country_code":"CN","type":"education","lineage":["https://openalex.org/I36399199"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Yu Zhang","raw_affiliation_strings":["School of Chemistry and Chemical Engineering, Nanjing University of Science and Technology, Nanjing 210094, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"School of Chemistry and Chemical Engineering, Nanjing University of Science and Technology, Nanjing 210094, China","institution_ids":["https://openalex.org/I36399199"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5022408966","display_name":"Jun Shan Luo","orcid":"https://orcid.org/0000-0002-8093-5345","observed_orcids":["https://orcid.org/0000-0002-8093-5345"]},"institutions":[{"id":"https://openalex.org/I36399199","display_name":"Nanjing University of Science and Technology","ror":"https://ror.org/00xp9wg62","country_code":"CN","type":"education","lineage":["https://openalex.org/I36399199"]}],"countries":["CN"],"is_corresponding":true,"raw_author_name":"Jun Luo","raw_affiliation_strings":["School of Chemistry and Chemical Engineering, Nanjing University of Science and Technology, Nanjing 210094, China"],"raw_orcid":"https://orcid.org/0000-0002-8093-5345","affiliations":[{"raw_affiliation_string":"School of Chemistry and Chemical Engineering, Nanjing University of Science and Technology, Nanjing 210094, China","institution_ids":["https://openalex.org/I36399199"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":1,"corresponding_author_ids":["https://openalex.org/A5022408966"],"corresponding_institution_ids":["https://openalex.org/I36399199"],"apc_list":{"value":4500,"currency":"USD","value_usd":4500},"apc_paid":null,"fwci":0.5249,"has_fulltext":false,"cited_by_count":6,"citation_normalized_percentile":{"value":0.49967987,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":95,"max":97},"biblio":{"volume":"69","issue":"9","first_page":"3179","last_page":"3189"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T11881","display_name":"Crystallization and Solubility Studies","score":0.9848999977111816,"subfield":{"id":"https://openalex.org/subfields/2505","display_name":"Materials Chemistry"},"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/T11881","display_name":"Crystallization and Solubility Studies","score":0.9848999977111816,"subfield":{"id":"https://openalex.org/subfields/2505","display_name":"Materials Chemistry"},"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/T10402","display_name":"Phase Equilibria and Thermodynamics","score":0.010900000110268593,"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/T12852","display_name":"Chemical Thermodynamics and Molecular Structure","score":0.00139999995008111,"subfield":{"id":"https://openalex.org/subfields/1605","display_name":"Organic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/hmx","display_name":"HMX","score":0.7789999842643738},{"id":"https://openalex.org/keywords/solid-liquid-equilibrium","display_name":"solid-liquid equilibrium","score":0.8690000176429749},{"id":"https://openalex.org/keywords/solubility","display_name":"solubility","score":0.9629999995231628},{"id":"https://openalex.org/keywords/thermodynamics-of-dissolution","display_name":"dissolution thermodynamics","score":0.8709999918937683},{"id":"https://openalex.org/keywords/polymorphism","display_name":"polymorphism","score":0.7620000243186951},{"id":"https://openalex.org/keywords/energetic-materials","display_name":"energetic materials","score":0.8650000095367432},{"id":"https://openalex.org/keywords/crystal-forms","display_name":"crystal forms","score":0.7279999852180481},{"id":"https://openalex.org/keywords/nrtl-model","display_name":"NRTL model","score":0.8029999732971191},{"id":"https://openalex.org/keywords/wilson-model","display_name":"Wilson model","score":0.7099999785423279},{"id":"https://openalex.org/keywords/apelblat-equation","display_name":"Apelblat equation","score":0.8569999933242798},{"id":"https://openalex.org/keywords/lambdah-equation","display_name":"\u03bbh equation","score":0.5860000252723694},{"id":"https://openalex.org/keywords/gibbs-free-energy-of-dissolution","display_name":"Gibbs free energy of dissolution","score":0.6639999747276306},{"id":"https://openalex.org/keywords/crystallization","display_name":"crystallization","score":0.6549999713897705}],"concepts":[{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.8752535581588745},{"id":"https://openalex.org/C40117563","wikidata":"https://www.wikidata.org/wiki/Q1996101","display_name":"Non-random two-liquid model","level":4,"score":0.8229082226753235},{"id":"https://openalex.org/C155574463","wikidata":"https://www.wikidata.org/wiki/Q170731","display_name":"Solubility","level":2,"score":0.7775369882583618},{"id":"https://openalex.org/C146477669","wikidata":"https://www.wikidata.org/wiki/Q334631","display_name":"Gibbs free energy","level":2,"score":0.6434038877487183},{"id":"https://openalex.org/C3288061","wikidata":"https://www.wikidata.org/wiki/Q161064","display_name":"Enthalpy","level":2,"score":0.6347686052322388},{"id":"https://openalex.org/C88380143","wikidata":"https://www.wikidata.org/wiki/Q416674","display_name":"Dissolution","level":2,"score":0.6228973865509033},{"id":"https://openalex.org/C97355855","wikidata":"https://www.wikidata.org/wiki/Q11473","display_name":"Thermodynamics","level":1,"score":0.5652099251747131},{"id":"https://openalex.org/C2779858419","wikidata":"https://www.wikidata.org/wiki/Q407153","display_name":"Ethyl acetate","level":2,"score":0.524827778339386},{"id":"https://openalex.org/C203036418","wikidata":"https://www.wikidata.org/wiki/Q284256","display_name":"Crystallization","level":2,"score":0.5003926753997803},{"id":"https://openalex.org/C2780256110","wikidata":"https://www.wikidata.org/wiki/Q416065","display_name":"Cyclopentanone","level":3,"score":0.4326323866844177},{"id":"https://openalex.org/C2775997716","wikidata":"https://www.wikidata.org/wiki/Q414189","display_name":"Methyl acetate","level":3,"score":0.4208610951900482},{"id":"https://openalex.org/C170961132","wikidata":"https://www.wikidata.org/wiki/Q745224","display_name":"Activity coefficient","level":3,"score":0.4102388918399811},{"id":"https://openalex.org/C147789679","wikidata":"https://www.wikidata.org/wiki/Q11372","display_name":"Physical chemistry","level":1,"score":0.3878456652164459},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.38165566325187683},{"id":"https://openalex.org/C2776673659","wikidata":"https://www.wikidata.org/wiki/Q47512","display_name":"Acetic acid","level":2,"score":0.25508010387420654},{"id":"https://openalex.org/C184651966","wikidata":"https://www.wikidata.org/wiki/Q906356","display_name":"Aqueous solution","level":2,"score":0.17511653900146484},{"id":"https://openalex.org/C161790260","wikidata":"https://www.wikidata.org/wiki/Q82264","display_name":"Catalysis","level":2,"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/acs.jced.4c00273","doi":"https://doi.org/10.1021/acs.jced.4c00273","is_oa":false,"landing_page_url":"https://doi.org/10.1021/acs.jced.4c00273","pdf_url":null,"source":{"id":"https://openalex.org/S204459408","display_name":"Journal of Chemical & Engineering Data","issn_l":"0021-9568","issn":["0021-9568","1520-5134"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-c","jufo-1","norway-1","poland-70","russia-white-list-2"],"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":"Journal of Chemical &amp; Engineering Data","raw_type":"journal-article"}],"best_oa_location":null,"sustainable_development_goals":[],"study_designs":[],"awards":[{"id":"https://openalex.org/G1829278544","display_name":"\u9ad8\u6c27\u5316\u5ea6\u6c2e\u6742\u91d1\u521a\u70f7\u9aa8\u67b6\u6784\u5efa\u53ca\u5176\u9ad8\u80fd\u91cf\u5bc6\u5ea6\u884d\u751f\u7269\u7684\u5408\u6210\u4e0e\u6027\u80fd\u7814\u7a76","funder_award_id":"22075144","funder_id":"https://openalex.org/F4320321001","funder_display_name":"National Natural Science Foundation of China"}],"funders":[{"id":"https://openalex.org/F4320321001","display_name":"National Natural Science Foundation of China","ror":"https://ror.org/01h0zpd94"}],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":37,"referenced_works":["https://openalex.org/W608264762","https://openalex.org/W1968466177","https://openalex.org/W1972965339","https://openalex.org/W2014530204","https://openalex.org/W2033899672","https://openalex.org/W2046181687","https://openalex.org/W2057830953","https://openalex.org/W2071574257","https://openalex.org/W2072350039","https://openalex.org/W2072476365","https://openalex.org/W2089869699","https://openalex.org/W2143770134","https://openalex.org/W2170576635","https://openalex.org/W2171250148","https://openalex.org/W2314077734","https://openalex.org/W2323454542","https://openalex.org/W2585725661","https://openalex.org/W2893389188","https://openalex.org/W2950555579","https://openalex.org/W2951050136","https://openalex.org/W2969633524","https://openalex.org/W2996727351","https://openalex.org/W3007244061","https://openalex.org/W3019923366","https://openalex.org/W3045239630","https://openalex.org/W4244779459","https://openalex.org/W4251032212","https://openalex.org/W4310012382","https://openalex.org/W4320921421","https://openalex.org/W4327920726","https://openalex.org/W4379390463","https://openalex.org/W4385760132","https://openalex.org/W4386812151","https://openalex.org/W4389110101","https://openalex.org/W4395078053","https://openalex.org/W4395694240","https://openalex.org/W4400481518"],"related_works":["https://openalex.org/W3007244061","https://openalex.org/W2560680641","https://openalex.org/W2063453725","https://openalex.org/W4401411421","https://openalex.org/W7172387478","https://openalex.org/W2357007299","https://openalex.org/W4405532143","https://openalex.org/W1520353778","https://openalex.org/W4401972663","https://openalex.org/W2353883993"],"abstract_inverted_index":{"For":[0],"solid-state":[1],"energetic":[2],"materials,":[3],"it":[4],"might":[5],"be":[6],"able":[7],"to":[8,53],"exist":[9],"in":[10,63,106,192],"different":[11,25,179,193],"crystal":[12,180],"structures,":[13],"which":[14,120],"is":[15],"well-known":[16],"as":[17,29,144],"polymorphism.":[18],"Different":[19],"polymorphs":[20],"of":[21,43,100,164,173,178,182],"the":[22,39,60,98,122,126,130,134,139,145,157,168,171],"crystals":[23],"exhibit":[24],"physiochemical":[26],"properties,":[27,142],"such":[28,143],"solubility,":[30],"dissolution":[31,140],"rate,":[32],"morphology,":[33],"etc":[34],".":[35],"In":[36,137],"this":[37],"work,":[38],"solid\u2013liquid":[40],"phase":[41,176],"equilibrium":[42],"1,3,5,7-tetranitro-1,3,5,7-tetraazacyclooctane":[44],"form":[45],"\u03b1":[46],"(\u03b1-HMX)":[47],"over":[48],"various":[49],"temperature":[50,105],"ranges":[51],"(298.15":[52],"358.15":[54],"K)":[55],"was":[56],"experimentally":[57],"determined":[58],"using":[59],"dynamic":[61],"method":[62],"12":[64],"pure":[65],"solvents,":[66],"including":[67],"acetone,":[68],"pyridine,":[69],"acetic":[70],"acid,":[71],"2-butanone,":[72],"cyclopentanone,":[73],"acetonitrile,":[74],"methyl":[75,83],"acetate,":[76,78,80],"ethyl":[77,81],"isopropyl":[79],"acetoacetate,":[82],"propyl":[84],"ketone,":[85],"and":[86,133,148,160,175,184],"dimethyl":[87],"sulfoxide":[88],"(DMSO),":[89],"at":[90],"atmospheric":[91],"pressure.":[92],"The":[93,110],"experimental":[94,111,158],"results":[95,166],"indicate":[96],"that":[97],"solubility":[99,112],"\u03b1-HMX":[101],"increases":[102],"with":[103,116,156],"increasing":[104],"all":[107],"test":[108],"solvents.":[109,194],"data":[113,159],"were":[114,153],"correlated":[115],"four":[117],"thermodynamic":[118,141],"models,":[119],"are":[121],"modified":[123],"Apelblat":[124],"equation,":[125,129],"\u03bb":[127],"h":[128],"Wilson":[131],"model,":[132],"NRTL":[135,161],"model.":[136,162],"addition,":[138],"enthalpy,":[146],"entropy,":[147],"Gibbs":[149],"free":[150],"energy":[151],"change,":[152],"also":[154],"calculated":[155],"All":[163],"these":[165],"lay":[167],"foundation":[169],"for":[170,187],"study":[172],"preparation":[174],"transformation":[177],"forms":[181],"HMX":[183],"provide":[185],"guidance":[186],"designing":[188],"suitable":[189],"crystallization":[190],"methods":[191]},"counts_by_year":[{"year":2026,"cited_by_count":3},{"year":2025,"cited_by_count":3}],"updated_date":"2026-10-14T16:39:01.820549","created_date":"2024-08-09T00:00:00"}
