{"id":"https://openalex.org/W4387764750","doi":"https://doi.org/10.1021/acs.jcim.3c01331","title":"Structural Determination and Hierarchical Evolution of Transition Metal Clusters Based on an Improved Self-Adaptive Differential Evolution with Neighborhood Search Algorithm","display_name":"Structural Determination and Hierarchical Evolution of Transition Metal Clusters Based on an Improved Self-Adaptive Differential Evolution with Neighborhood Search Algorithm","publication_year":2023,"publication_date":"2023-10-19","ids":{"openalex":"https://openalex.org/W4387764750","doi":"https://doi.org/10.1021/acs.jcim.3c01331","pmid":"https://pubmed.ncbi.nlm.nih.gov/37853630"},"language":"en","primary_location":{"id":"doi:10.1021/acs.jcim.3c01331","is_oa":false,"landing_page_url":"https://doi.org/10.1021/acs.jcim.3c01331","pdf_url":null,"source":{"id":"https://openalex.org/S167262187","display_name":"Journal of Chemical Information and Modeling","issn_l":"1549-9596","issn":["1549-9596","1549-960X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"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 Information and Modeling","raw_type":"journal-article"},"type":"article","indexed_in":["crossref","pubmed"],"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/A5061097812","display_name":"Weihua Yang","orcid":null},"institutions":[{"id":"https://openalex.org/I191208505","display_name":"Xiamen University","ror":"https://ror.org/00mcjh785","country_code":"CN","type":"education","lineage":["https://openalex.org/I191208505"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Wei-Hua Yang","raw_affiliation_strings":["Department of Physics, Xiamen University, Xiamen 361005, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Physics, Xiamen University, Xiamen 361005, China","institution_ids":["https://openalex.org/I191208505"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5011757223","display_name":"Fangqi Yu","orcid":null},"institutions":[{"id":"https://openalex.org/I191208505","display_name":"Xiamen University","ror":"https://ror.org/00mcjh785","country_code":"CN","type":"education","lineage":["https://openalex.org/I191208505"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Fang-Qi Yu","raw_affiliation_strings":["Department of Physics, Xiamen University, Xiamen 361005, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Physics, Xiamen University, Xiamen 361005, China","institution_ids":["https://openalex.org/I191208505"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5004650764","display_name":"Rao Huang","orcid":"https://orcid.org/0000-0001-9913-2123"},"institutions":[{"id":"https://openalex.org/I191208505","display_name":"Xiamen University","ror":"https://ror.org/00mcjh785","country_code":"CN","type":"education","lineage":["https://openalex.org/I191208505"]}],"countries":["CN"],"is_corresponding":true,"raw_author_name":"Rao Huang","raw_affiliation_strings":["Department of Physics, Xiamen University, Xiamen 361005, China"],"raw_orcid":"https://orcid.org/0000-0001-9913-2123","affiliations":[{"raw_affiliation_string":"Department of Physics, Xiamen University, Xiamen 361005, China","institution_ids":["https://openalex.org/I191208505"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5017745185","display_name":"Guifang Shao","orcid":"https://orcid.org/0000-0001-6189-2207"},"institutions":[{"id":"https://openalex.org/I75867142","display_name":"Xiamen University of Technology","ror":"https://ror.org/01285e189","country_code":"CN","type":"education","lineage":["https://openalex.org/I75867142"]}],"countries":["CN"],"is_corresponding":true,"raw_author_name":"Gui-Fang Shao","raw_affiliation_strings":["Pen-Tung Sah Institute of Micro-Nano Science and Technology, Xiamen University, Xiamen 361005, China"],"raw_orcid":"https://orcid.org/0000-0001-6189-2207","affiliations":[{"raw_affiliation_string":"Pen-Tung Sah Institute of Micro-Nano Science and Technology, Xiamen University, Xiamen 361005, China","institution_ids":["https://openalex.org/I75867142"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5103096389","display_name":"Tun-Dong Liu","orcid":"https://orcid.org/0000-0001-8159-2287"},"institutions":[{"id":"https://openalex.org/I75867142","display_name":"Xiamen University of Technology","ror":"https://ror.org/01285e189","country_code":"CN","type":"education","lineage":["https://openalex.org/I75867142"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Tun-Dong Liu","raw_affiliation_strings":["Pen-Tung Sah Institute of Micro-Nano Science and Technology, Xiamen University, Xiamen 361005, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Pen-Tung Sah Institute of Micro-Nano Science and Technology, Xiamen University, Xiamen 361005, China","institution_ids":["https://openalex.org/I75867142"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5100461045","display_name":"Yu\u2010Hua Wen","orcid":"https://orcid.org/0000-0002-0578-7506"},"institutions":[{"id":"https://openalex.org/I191208505","display_name":"Xiamen University","ror":"https://ror.org/00mcjh785","country_code":"CN","type":"education","lineage":["https://openalex.org/I191208505"]}],"countries":["CN"],"is_corresponding":true,"raw_author_name":"Yu-Hua Wen","raw_affiliation_strings":["Department of Physics, Xiamen University, Xiamen 361005, China"],"raw_orcid":"https://orcid.org/0000-0002-0578-7506","affiliations":[{"raw_affiliation_string":"Department of Physics, Xiamen University, Xiamen 361005, China","institution_ids":["https://openalex.org/I191208505"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":2,"corresponding_author_ids":["https://openalex.org/A5004650764","https://openalex.org/A5017745185","https://openalex.org/A5100461045"],"corresponding_institution_ids":["https://openalex.org/I191208505","https://openalex.org/I75867142"],"apc_list":null,"apc_paid":null,"fwci":0.5037,"has_fulltext":false,"cited_by_count":6,"citation_normalized_percentile":{"value":0.56404457,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":94,"max":98},"biblio":{"volume":"63","issue":"21","first_page":"6727","last_page":"6739"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T11948","display_name":"Machine Learning in Materials Science","score":0.9997000098228455,"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/T11948","display_name":"Machine Learning in Materials Science","score":0.9997000098228455,"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/T10002","display_name":"Advanced Chemical Physics Studies","score":0.9991999864578247,"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"}},{"id":"https://openalex.org/T10192","display_name":"Catalytic Processes in Materials Science","score":0.9991000294685364,"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"}}],"keywords":[{"id":"https://openalex.org/keywords/icosahedral-symmetry","display_name":"Icosahedral symmetry","score":0.8661599159240723},{"id":"https://openalex.org/keywords/cluster","display_name":"Cluster (spacecraft)","score":0.7033149003982544},{"id":"https://openalex.org/keywords/differential-evolution","display_name":"Differential evolution","score":0.5924022793769836},{"id":"https://openalex.org/keywords/atom","display_name":"Atom (system on chip)","score":0.45825424790382385},{"id":"https://openalex.org/keywords/magic-number","display_name":"Magic number (chemistry)","score":0.44765883684158325},{"id":"https://openalex.org/keywords/similarity","display_name":"Similarity (geometry)","score":0.4248505234718323},{"id":"https://openalex.org/keywords/molecular-dynamics","display_name":"Molecular dynamics","score":0.42439475655555725},{"id":"https://openalex.org/keywords/algorithm","display_name":"Algorithm","score":0.38992148637771606},{"id":"https://openalex.org/keywords/materials-science","display_name":"Materials science","score":0.3679977059364319},{"id":"https://openalex.org/keywords/chemical-physics","display_name":"Chemical physics","score":0.3550362288951874},{"id":"https://openalex.org/keywords/physics","display_name":"Physics","score":0.3374333381652832},{"id":"https://openalex.org/keywords/computer-science","display_name":"Computer science","score":0.3064400851726532},{"id":"https://openalex.org/keywords/chemistry","display_name":"Chemistry","score":0.3024846315383911},{"id":"https://openalex.org/keywords/crystallography","display_name":"Crystallography","score":0.29148128628730774},{"id":"https://openalex.org/keywords/electronic-structure","display_name":"Electronic structure","score":0.170462965965271},{"id":"https://openalex.org/keywords/computational-chemistry","display_name":"Computational chemistry","score":0.15637734532356262}],"concepts":[{"id":"https://openalex.org/C113709186","wikidata":"https://www.wikidata.org/wiki/Q5986738","display_name":"Icosahedral symmetry","level":2,"score":0.8661599159240723},{"id":"https://openalex.org/C164866538","wikidata":"https://www.wikidata.org/wiki/Q367351","display_name":"Cluster (spacecraft)","level":2,"score":0.7033149003982544},{"id":"https://openalex.org/C74750220","wikidata":"https://www.wikidata.org/wiki/Q2662197","display_name":"Differential evolution","level":2,"score":0.5924022793769836},{"id":"https://openalex.org/C58312451","wikidata":"https://www.wikidata.org/wiki/Q4817200","display_name":"Atom (system on chip)","level":2,"score":0.45825424790382385},{"id":"https://openalex.org/C2776921874","wikidata":"https://www.wikidata.org/wiki/Q427504","display_name":"Magic number (chemistry)","level":3,"score":0.44765883684158325},{"id":"https://openalex.org/C103278499","wikidata":"https://www.wikidata.org/wiki/Q254465","display_name":"Similarity (geometry)","level":3,"score":0.4248505234718323},{"id":"https://openalex.org/C59593255","wikidata":"https://www.wikidata.org/wiki/Q901663","display_name":"Molecular dynamics","level":2,"score":0.42439475655555725},{"id":"https://openalex.org/C11413529","wikidata":"https://www.wikidata.org/wiki/Q8366","display_name":"Algorithm","level":1,"score":0.38992148637771606},{"id":"https://openalex.org/C192562407","wikidata":"https://www.wikidata.org/wiki/Q228736","display_name":"Materials science","level":0,"score":0.3679977059364319},{"id":"https://openalex.org/C159467904","wikidata":"https://www.wikidata.org/wiki/Q2001702","display_name":"Chemical physics","level":1,"score":0.3550362288951874},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.3374333381652832},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.3064400851726532},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.3024846315383911},{"id":"https://openalex.org/C8010536","wikidata":"https://www.wikidata.org/wiki/Q160398","display_name":"Crystallography","level":1,"score":0.29148128628730774},{"id":"https://openalex.org/C86025842","wikidata":"https://www.wikidata.org/wiki/Q5358432","display_name":"Electronic structure","level":2,"score":0.170462965965271},{"id":"https://openalex.org/C147597530","wikidata":"https://www.wikidata.org/wiki/Q369472","display_name":"Computational chemistry","level":1,"score":0.15637734532356262},{"id":"https://openalex.org/C149635348","wikidata":"https://www.wikidata.org/wiki/Q193040","display_name":"Embedded system","level":1,"score":0.0},{"id":"https://openalex.org/C115961682","wikidata":"https://www.wikidata.org/wiki/Q860623","display_name":"Image (mathematics)","level":2,"score":0.0},{"id":"https://openalex.org/C154945302","wikidata":"https://www.wikidata.org/wiki/Q11660","display_name":"Artificial intelligence","level":1,"score":0.0},{"id":"https://openalex.org/C199360897","wikidata":"https://www.wikidata.org/wiki/Q9143","display_name":"Programming language","level":1,"score":0.0}],"mesh":[{"descriptor_ui":"D000465","descriptor_name":"Algorithms","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D000465","descriptor_name":"Algorithms","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D000465","descriptor_name":"Algorithms","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D010825","descriptor_name":"Physics","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D010825","descriptor_name":"Physics","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D010825","descriptor_name":"Physics","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D016208","descriptor_name":"Databases, Factual","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D016208","descriptor_name":"Databases, Factual","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D016208","descriptor_name":"Databases, Factual","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D049109","descriptor_name":"Cell Proliferation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D049109","descriptor_name":"Cell Proliferation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D049109","descriptor_name":"Cell Proliferation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false}],"locations_count":2,"locations":[{"id":"doi:10.1021/acs.jcim.3c01331","is_oa":false,"landing_page_url":"https://doi.org/10.1021/acs.jcim.3c01331","pdf_url":null,"source":{"id":"https://openalex.org/S167262187","display_name":"Journal of Chemical Information and Modeling","issn_l":"1549-9596","issn":["1549-9596","1549-960X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"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 Information and Modeling","raw_type":"journal-article"},{"id":"pmid:37853630","is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/37853630","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,"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":"Journal of chemical information and modeling","raw_type":null}],"best_oa_location":null,"sustainable_development_goals":[],"awards":[{"id":"https://openalex.org/G2624673310","display_name":null,"funder_award_id":"2022J02001","funder_id":"https://openalex.org/F4320321878","funder_display_name":"Natural Science Foundation of Fujian Province"},{"id":"https://openalex.org/G7667544513","display_name":null,"funder_award_id":"20720220028","funder_id":"https://openalex.org/F4320335787","funder_display_name":"Fundamental Research Funds for the Central Universities"}],"funders":[{"id":"https://openalex.org/F4320321878","display_name":"Natural Science Foundation of Fujian Province","ror":null},{"id":"https://openalex.org/F4320335787","display_name":"Fundamental Research Funds for the Central Universities","ror":null}],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":61,"referenced_works":["https://openalex.org/W581892686","https://openalex.org/W1490742179","https://openalex.org/W1494176118","https://openalex.org/W1966753000","https://openalex.org/W1969707204","https://openalex.org/W1971179163","https://openalex.org/W1974250533","https://openalex.org/W1976699960","https://openalex.org/W1985293765","https://openalex.org/W1985535010","https://openalex.org/W1986470117","https://openalex.org/W1992961181","https://openalex.org/W1996599361","https://openalex.org/W2006009797","https://openalex.org/W2006035385","https://openalex.org/W2008831465","https://openalex.org/W2011595710","https://openalex.org/W2030143939","https://openalex.org/W2037978495","https://openalex.org/W2044055804","https://openalex.org/W2045799768","https://openalex.org/W2047327932","https://openalex.org/W2047948161","https://openalex.org/W2051491506","https://openalex.org/W2056883963","https://openalex.org/W2064071593","https://openalex.org/W2074889196","https://openalex.org/W2075023892","https://openalex.org/W2075300911","https://openalex.org/W2079990392","https://openalex.org/W2080906881","https://openalex.org/W2083830300","https://openalex.org/W2085148121","https://openalex.org/W2090059521","https://openalex.org/W2094135064","https://openalex.org/W2095146078","https://openalex.org/W2099655666","https://openalex.org/W2115661144","https://openalex.org/W2117000100","https://openalex.org/W2124810375","https://openalex.org/W2126224336","https://openalex.org/W2129724855","https://openalex.org/W2134319176","https://openalex.org/W2134685240","https://openalex.org/W2169000524","https://openalex.org/W2182168433","https://openalex.org/W2315332086","https://openalex.org/W2327818780","https://openalex.org/W2493470962","https://openalex.org/W2624266408","https://openalex.org/W2794779079","https://openalex.org/W2904038126","https://openalex.org/W2979330974","https://openalex.org/W3012620293","https://openalex.org/W3027435758","https://openalex.org/W3084447781","https://openalex.org/W3107459753","https://openalex.org/W4211194514","https://openalex.org/W4229378830","https://openalex.org/W4229499352","https://openalex.org/W4362666160"],"related_works":["https://openalex.org/W2335637493","https://openalex.org/W2587076120","https://openalex.org/W2072193010","https://openalex.org/W2066534028","https://openalex.org/W2038628520","https://openalex.org/W2755378999","https://openalex.org/W202437351","https://openalex.org/W2215766191","https://openalex.org/W1988604544","https://openalex.org/W2139114147"],"abstract_inverted_index":{"Determining":[0],"the":[1,6,74,93,104,109,122,138,163,179,222,230,241,244,260,270,292,299],"optimal":[2],"structures":[3,76,167,226],"and":[4,44,64,82,124,131,153,204,217,229,235,290],"clarifying":[5],"corresponding":[7],"hierarchical":[8],"evolution":[9,53,140,200],"of":[10,15,24,30,42,77,92,127,168,181,193,201,224,243,259,279,294,302],"transition":[11],"metal":[12],"clusters":[13,25,129,171,180,206,231,245],"are":[14],"fundamental":[16],"importance":[17],"for":[18,274,298],"their":[19,146],"applications.":[20],"The":[21,90,198],"global":[22,295],"optimization":[23,296],"containing":[26],"a":[27,34,49,253,276],"large":[28],"number":[29,262],"atoms,":[31],"however,":[32],"is":[33],"vastly":[35],"challenging":[36],"task":[37],"encountered":[38],"in":[39,108,162,287],"many":[40],"fields":[41],"physics":[43],"chemistry.":[45],"In":[46],"this":[47],"work,":[48],"high-efficiency":[50],"self-adaptive":[51],"differential":[52],"with":[54,103,141,158,188,232],"neighborhood":[55],"search":[56,73],"(SaNSDE)":[57],"algorithm,":[58],"which":[59,194,282],"introduced":[60,119],"an":[61,65],"optimized":[62],"cross-operation":[63],"improved":[66],"Basin":[67],"Hopping":[68],"module,":[69],"was":[70,96,134,227,246],"employed":[71],"to":[72,120,136],"lowest-energy":[75],"Co":[78],"N,":[79,81],"Pt":[80],"Fe":[83,169,205],"N":[84,86,170],"(":[85],"=":[87],"3\u2013200)":[88],"clusters.":[89,303],"performance":[91],"SaNSDE":[94],"algorithm":[95],"first":[97],"evaluated":[98],"by":[99,144],"comparing":[100],"our":[101,175],"results":[102,106,160,176],"parallel":[105],"collected":[107],"Cambridge":[110],"Cluster":[111],"Database":[112],"(CCD).":[113],"Subsequently,":[114],"different":[115,185],"analytical":[116],"methods":[117],"were":[118,172,238],"investigate":[121],"structural":[123,139,151,199,300],"energetic":[125],"properties":[126],"these":[128],"systematically,":[130],"special":[132],"attention":[133],"paid":[135],"elucidating":[137],"cluster":[142,255,280],"size":[143],"exploring":[145],"overall":[147],"shape,":[148],"atomic":[149],"arrangement,":[150],"similarity,":[152],"growth":[154,242,272],"pattern.":[155],"By":[156],"comparison":[157],"those":[159],"listed":[161],"CCD,":[164],"13":[165],"lower-energy":[166],"discovered.":[173],"Moreover,":[174],"reveal":[177],"that":[178],"three":[182],"metals":[183],"had":[184],"magic":[186],"numbers":[187],"superior":[189],"stable":[190],"structures,":[191],"most":[192],"possessed":[195],"high":[196],"symmetry.":[197],"Co,":[202],"Pt,":[203],"could":[207],"be,":[208],"respectively,":[209],"considered":[210],"as":[211],"predominantly":[212],"closed-shell":[213],"icosahedral,":[214],"Marks":[215],"decahedral,":[216],"disordered":[218],"icosahedral-ring":[219],"growth.":[220],"Further,":[221],"formation":[223],"shell":[225],"discovered,":[228],"hcp-,":[233],"fcc-,":[234],"bcc-like":[236],"configurations":[237],"ascertained.":[239],"Nevertheless,":[240],"not":[247],"simply":[248],"atom-to-atom":[249],"piling":[250],"up":[251],"on":[252],"given":[254],"despite":[256],"gradual":[257],"saturation":[258],"coordination":[261],"toward":[263],"its":[264],"bulk":[265],"limit.":[266],"Our":[267],"work":[268],"identifies":[269],"general":[271],"trends":[273],"such":[275],"wide":[277],"region":[278],"sizes,":[281],"would":[283],"be":[284],"unbearably":[285],"expensive":[286],"first-principles":[288],"calculations,":[289],"advances":[291],"development":[293],"algorithms":[297],"prediction":[301]},"counts_by_year":[{"year":2026,"cited_by_count":2},{"year":2025,"cited_by_count":2},{"year":2024,"cited_by_count":2}],"updated_date":"2026-06-15T08:34:33.830935","created_date":"2025-10-10T00:00:00"}