{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,7,22]],"date-time":"2026-07-22T02:21:24Z","timestamp":1784686884178,"version":"3.55.0"},"reference-count":172,"publisher":"American Chemical Society (ACS)","issue":"6","license":[{"start":{"date-parts":[[2026,3,6]],"date-time":"2026-03-06T00:00:00Z","timestamp":1772755200000},"content-version":"vor","delay-in-days":0,"URL":"https:\/\/creativecommons.org\/licenses\/by\/4.0\/"}],"funder":[{"DOI":"10.13039\/100023581","name":"National Science Foundation Graduate Research Fellowship Program","doi-asserted-by":"publisher","award":["2236869"],"award-info":[{"award-number":["2236869"]}],"id":[{"id":"10.13039\/100023581","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/100006151","name":"Basic Energy Sciences","doi-asserted-by":"publisher","award":["DE-SC0018412"],"award-info":[{"award-number":["DE-SC0018412"]}],"id":[{"id":"10.13039\/100006151","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/100006132","name":"Office of Science","doi-asserted-by":"publisher","award":["17-SC-20-SC"],"award-info":[{"award-number":["17-SC-20-SC"]}],"id":[{"id":"10.13039\/100006132","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/100000001","name":"National Science Foundation","doi-asserted-by":"publisher","award":["2410879"],"award-info":[{"award-number":["2410879"]}],"id":[{"id":"10.13039\/100000001","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/100000001","name":"National Science Foundation","doi-asserted-by":"publisher","award":["CHE-2143725"],"award-info":[{"award-number":["CHE-2143725"]}],"id":[{"id":"10.13039\/100000001","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/100000001","name":"National Science Foundation","doi-asserted-by":"publisher","award":["MRI-1828187"],"award-info":[{"award-number":["MRI-1828187"]}],"id":[{"id":"10.13039\/100000001","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/100000001","name":"National Science Foundation","doi-asserted-by":"publisher","award":["OAC-2410877"],"award-info":[{"award-number":["OAC-2410877"]}],"id":[{"id":"10.13039\/100000001","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Theory Comput."],"published-print":{"date-parts":[[2026,3,24]]},"DOI":"10.1021\/acs.jctc.5c01910","type":"journal-article","created":{"date-parts":[[2026,3,10]],"date-time":"2026-03-10T09:02:59Z","timestamp":1773133379000},"page":"2825-2845","source":"Crossref","is-referenced-by-count":4,"title":["Local Pair Natural Orbital-Based Coupled-Cluster Theory through Full Quadruples (DLPNO\u2013CCSDTQ)"],"prefix":"10.1021","volume":"22","author":[{"ORCID":"https:\/\/orcid.org\/0000-0002-6946-209X","authenticated-orcid":true,"given":"Andy","family":"Jiang","sequence":"first","affiliation":[{"name":"Center for Computational Quantum Chemistry, Department of Chemistry","place":["Athens, United States of America"]},{"name":"University of Georgia","place":["Athens, United States of America"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-2795-5483","authenticated-orcid":true,"given":"Devin A.","family":"Matthews","sequence":"additional","affiliation":[{"name":"Department of Chemistry","place":["Dallas, United States of America"]},{"name":"Southern Methodist University","place":["Dallas, United States of America"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"David","family":"Poole","sequence":"additional","affiliation":[{"name":"Center for Computational Molecular Science and Technology, School of Chemistry and Biochemistry, School of Computational Science and Engineering","place":["Atlanta, United States"]},{"name":"Georgia Institute of Technology","place":["Atlanta, United States"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0009-0004-1390-5279","authenticated-orcid":true,"given":"Connor G.","family":"Briggs","sequence":"additional","affiliation":[{"name":"Center for Computational Quantum Chemistry, Department of Chemistry","place":["Athens, United States of America"]},{"name":"University of Georgia","place":["Athens, United States of America"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Justin M.","family":"Turney","sequence":"additional","affiliation":[{"name":"Center for Computational Quantum Chemistry, Department of Chemistry","place":["Athens, United States of America"]},{"name":"University of Georgia","place":["Athens, United States of America"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-5570-7666","authenticated-orcid":true,"given":"C. David","family":"Sherrill","sequence":"additional","affiliation":[{"name":"Center for Computational Molecular Science and Technology, School of Chemistry and Biochemistry, School of Computational Science and Engineering","place":["Atlanta, United States"]},{"name":"Georgia Institute of Technology","place":["Atlanta, United States"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Henry F.","family":"Schaefer III","sequence":"additional","affiliation":[{"name":"Center for Computational Quantum Chemistry, Department of Chemistry","place":["Athens, United States of America"]},{"name":"University of Georgia","place":["Athens, United States of America"]}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"316","published-online":{"date-parts":[[2026,3,6]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"publisher","DOI":"10.1002\/9780470125915.ch2"},{"key":"ref2\/cit2","doi-asserted-by":"publisher","DOI":"10.1103\/RevModPhys.79.291"},{"key":"ref3\/cit3","doi-asserted-by":"publisher","DOI":"10.1016\/S0065-3276(08)60532-8"},{"key":"ref4\/cit4","unstructured":"Cramer, C. J.\n                      Essentials of Computational Chemistry\n                      ; John Wiley & Sons, 2002; pp. 191\u2013232."},{"key":"ref5\/cit5","doi-asserted-by":"publisher","DOI":"10.1063\/1.1811608"},{"key":"ref6\/cit6","doi-asserted-by":"publisher","DOI":"10.1063\/1.2206789"},{"key":"ref7\/cit7","doi-asserted-by":"publisher","DOI":"10.1063\/1.2835612"},{"key":"ref8\/cit8","doi-asserted-by":"publisher","DOI":"10.1063\/1.2348881"},{"key":"ref9\/cit9","doi-asserted-by":"publisher","DOI":"10.1063\/1.2755751"},{"key":"ref10\/cit10","doi-asserted-by":"publisher","DOI":"10.1063\/1.3489113"},{"key":"ref11\/cit11","doi-asserted-by":"publisher","DOI":"10.1063\/1.463930"},{"key":"ref12\/cit12","doi-asserted-by":"publisher","DOI":"10.1063\/1.461534"},{"key":"ref13\/cit13","doi-asserted-by":"publisher","DOI":"10.1063\/1.1383290"},{"key":"ref14\/cit14","doi-asserted-by":"publisher","DOI":"10.1080\/00268976.2010.523523"},{"key":"ref15\/cit15","doi-asserted-by":"publisher","DOI":"10.1063\/1.471518"},{"key":"ref16\/cit16","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jpca.7b05945"},{"key":"ref17\/cit17","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jpca.2c07248"},{"key":"ref18\/cit18","doi-asserted-by":"publisher","DOI":"10.1002\/qua.25202"},{"key":"ref19\/cit19","doi-asserted-by":"publisher","DOI":"10.1002\/qua.25284"},{"key":"ref20\/cit20","doi-asserted-by":"publisher","DOI":"10.1021\/acs.accounts.7b00603"},{"key":"ref21\/cit21","doi-asserted-by":"publisher","DOI":"10.1039\/D2CP04706C"},{"key":"ref22\/cit22","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.27283"},{"key":"ref23\/cit23","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.7b01138"},{"key":"ref24\/cit24","doi-asserted-by":"publisher","DOI":"10.1515\/pac-2025-0586"},{"key":"ref25\/cit25","doi-asserted-by":"publisher","DOI":"10.1063\/1.470240"},{"key":"ref26\/cit26","doi-asserted-by":"publisher","DOI":"10.1063\/1.471005"},{"key":"ref27\/cit27","doi-asserted-by":"publisher","DOI":"10.1063\/1.1425405"},{"key":"ref28\/cit28","doi-asserted-by":"publisher","DOI":"10.1063\/1.1462612"},{"key":"ref29\/cit29","doi-asserted-by":"publisher","DOI":"10.1063\/1.447591"},{"key":"ref30\/cit30","doi-asserted-by":"publisher","DOI":"10.1016\/S0065-3276(08)60050-7"},{"key":"ref31\/cit31","doi-asserted-by":"publisher","DOI":"10.1016\/0009-2614(90)87031-L"},{"key":"ref32\/cit32","doi-asserted-by":"publisher","DOI":"10.1063\/1.459226"},{"key":"ref33\/cit33","doi-asserted-by":"publisher","DOI":"10.1063\/1.459684"},{"key":"ref34\/cit34","doi-asserted-by":"publisher","DOI":"10.1016\/S0009-2614(89)87395-6"},{"key":"ref35\/cit35","doi-asserted-by":"publisher","DOI":"10.1063\/1.464480"},{"key":"ref36\/cit36","doi-asserted-by":"publisher","DOI":"10.1016\/S0009-2614(97)01144-5"},{"key":"ref37\/cit37","doi-asserted-by":"publisher","DOI":"10.1021\/ct4002762"},{"key":"ref38\/cit38","doi-asserted-by":"publisher","DOI":"10.1063\/1.5116151"},{"key":"ref39\/cit39","doi-asserted-by":"publisher","DOI":"10.1021\/ct3008777"},{"key":"ref40\/cit40","doi-asserted-by":"publisher","DOI":"10.1021\/ct500347q"},{"key":"ref41\/cit41","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jpca.9b04611"},{"key":"ref42\/cit42","doi-asserted-by":"publisher","DOI":"10.1021\/j100012a005"},{"key":"ref43\/cit43","doi-asserted-by":"publisher","DOI":"10.1063\/1.481544"},{"key":"ref44\/cit44","doi-asserted-by":"publisher","DOI":"10.1016\/0009-2614(91)80319-S"},{"key":"ref45\/cit45","doi-asserted-by":"publisher","DOI":"10.1063\/1.478736"},{"key":"ref46\/cit46","doi-asserted-by":"publisher","DOI":"10.1080\/00268976.2012.684897"},{"key":"ref47\/cit47","doi-asserted-by":"publisher","DOI":"10.1080\/00268976.2013.861526"},{"key":"ref48\/cit48","doi-asserted-by":"publisher","DOI":"10.1021\/jp030267v"},{"key":"ref49\/cit49","doi-asserted-by":"publisher","DOI":"10.1021\/jp0369084"},{"key":"ref50\/cit50","doi-asserted-by":"publisher","DOI":"10.1021\/jp902753s"},{"key":"ref51\/cit51","doi-asserted-by":"publisher","DOI":"10.1021\/jp4069448"},{"key":"ref52\/cit52","doi-asserted-by":"publisher","DOI":"10.1063\/1.4907278"},{"key":"ref53\/cit53","doi-asserted-by":"publisher","DOI":"10.1063\/1.476376"},{"key":"ref54\/cit54","doi-asserted-by":"publisher","DOI":"10.1063\/1.475961"},{"key":"ref55\/cit55","doi-asserted-by":"publisher","DOI":"10.1063\/1.1950567"},{"key":"ref56\/cit56","doi-asserted-by":"publisher","DOI":"10.1063\/1.2121589"},{"key":"ref57\/cit57","doi-asserted-by":"publisher","DOI":"10.1063\/1.2988052"},{"key":"ref58\/cit58","doi-asserted-by":"publisher","DOI":"10.1063\/1.4873138"},{"key":"ref59\/cit59","doi-asserted-by":"publisher","DOI":"10.1063\/1.4862501"},{"key":"ref60\/cit60","doi-asserted-by":"publisher","DOI":"10.1063\/1.4927247"},{"key":"ref61\/cit61","doi-asserted-by":"publisher","DOI":"10.1016\/0003-4916(83)90284-1"},{"key":"ref62\/cit62","doi-asserted-by":"publisher","DOI":"10.1002\/qua.560260825"},{"key":"ref63\/cit63","doi-asserted-by":"publisher","DOI":"10.1021\/ct400250u"},{"key":"ref64\/cit64","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.9b00957"},{"key":"ref65\/cit65","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.0c01077"},{"key":"ref66\/cit66","doi-asserted-by":"publisher","DOI":"10.1063\/1.5092505"},{"key":"ref67\/cit67","doi-asserted-by":"publisher","DOI":"10.1063\/1.5121867"},{"key":"ref68\/cit68","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.9b00985"},{"key":"ref69\/cit69","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.1c00933"},{"key":"ref70\/cit70","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.2c00460"},{"key":"ref71\/cit71","doi-asserted-by":"publisher","DOI":"10.1063\/1.4768233"},{"key":"ref72\/cit72","doi-asserted-by":"publisher","DOI":"10.1063\/1.4732310"},{"key":"ref73\/cit73","doi-asserted-by":"publisher","DOI":"10.1063\/1.4768241"},{"key":"ref74\/cit74","doi-asserted-by":"publisher","DOI":"10.1063\/1.4876016"},{"key":"ref75\/cit75","doi-asserted-by":"publisher","DOI":"10.1063\/5.0077770"},{"key":"ref76\/cit76","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.2c00996"},{"key":"ref77\/cit77","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.10003"},{"key":"ref78\/cit78","doi-asserted-by":"publisher","DOI":"10.1063\/1.2244566"},{"key":"ref79\/cit79","doi-asserted-by":"publisher","DOI":"10.1063\/1.3218842"},{"key":"ref80\/cit80","doi-asserted-by":"publisher","DOI":"10.1021\/jp100782u"},{"key":"ref81\/cit81","doi-asserted-by":"publisher","DOI":"10.1016\/0009-2614(83)80703-9"},{"key":"ref82\/cit82","doi-asserted-by":"publisher","DOI":"10.1063\/1.479957"},{"key":"ref83\/cit83","doi-asserted-by":"publisher","DOI":"10.1063\/1.1323265"},{"key":"ref84\/cit84","doi-asserted-by":"publisher","DOI":"10.1063\/1.1330207"},{"key":"ref85\/cit85","doi-asserted-by":"publisher","DOI":"10.1063\/1.1470497"},{"key":"ref86\/cit86","doi-asserted-by":"publisher","DOI":"10.1039\/B304550A"},{"key":"ref87\/cit87","doi-asserted-by":"publisher","DOI":"10.1080\/00268970500096251"},{"key":"ref88\/cit88","doi-asserted-by":"publisher","DOI":"10.1135\/cccc20050837"},{"key":"ref89\/cit89","doi-asserted-by":"publisher","DOI":"10.1063\/1.2902285"},{"key":"ref90\/cit90","doi-asserted-by":"publisher","DOI":"10.1063\/1.3632085"},{"key":"ref91\/cit91","doi-asserted-by":"publisher","DOI":"10.1063\/1.4819401"},{"key":"ref92\/cit92","doi-asserted-by":"publisher","DOI":"10.1063\/1.4984322"},{"key":"ref93\/cit93","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.8b00442"},{"key":"ref94\/cit94","doi-asserted-by":"publisher","DOI":"10.1063\/1.3086717"},{"key":"ref95\/cit95","doi-asserted-by":"publisher","DOI":"10.1063\/1.3173827"},{"key":"ref96\/cit96","doi-asserted-by":"publisher","DOI":"10.1063\/1.4773581"},{"key":"ref97\/cit97","doi-asserted-by":"publisher","DOI":"10.1063\/1.4821834"},{"key":"ref98\/cit98","doi-asserted-by":"publisher","DOI":"10.1021\/ct501129s"},{"key":"ref99\/cit99","doi-asserted-by":"publisher","DOI":"10.1021\/ct500725e"},{"key":"ref100\/cit100","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.5b00843"},{"key":"ref101\/cit101","doi-asserted-by":"publisher","DOI":"10.1063\/1.4926879"},{"key":"ref102\/cit102","doi-asserted-by":"publisher","DOI":"10.1063\/1.4939030"},{"key":"ref103\/cit103","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.7b00554"},{"key":"ref104\/cit104","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.7b00799"},{"key":"ref105\/cit105","doi-asserted-by":"publisher","DOI":"10.1063\/1.5011798"},{"key":"ref106\/cit106","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.7b01141"},{"key":"ref107\/cit107","doi-asserted-by":"publisher","DOI":"10.1063\/5.0219963"},{"key":"ref108\/cit108","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.4c01716"},{"key":"ref109\/cit109","doi-asserted-by":"publisher","DOI":"10.1063\/5.0257672"},{"key":"ref110\/cit110","doi-asserted-by":"publisher","DOI":"10.1063\/1.4981521"},{"key":"ref111\/cit111","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.9b00511"},{"key":"ref112\/cit112","doi-asserted-by":"publisher","unstructured":"Fishman, V.; L\u00f6rincz, B. D.; Semidalas, E.; Barman, A.; Martin, J. M. L.; Nagy, P. R.; K\u00e1llay, M.; Development of local natural orbital arbitrary order coupled cluster methods and assessment through connected quadruples. 2026, 10.26434\/chemrxiv.10001857\/v1.","DOI":"10.26434\/chemrxiv.10001857\/v1"},{"key":"ref113\/cit113","author":"Martin J. M. L.","year":"2024","journal-title":"arXiv:2410.01358"},{"key":"ref114\/cit114","doi-asserted-by":"publisher","DOI":"10.1063\/5.0127588"},{"key":"ref115\/cit115","doi-asserted-by":"publisher","DOI":"10.1039\/D4CP02700K"},{"key":"ref116\/cit116","doi-asserted-by":"publisher","DOI":"10.1080\/00268976.2023.2252114"},{"key":"ref117\/cit117","doi-asserted-by":"publisher","DOI":"10.1016\/0009-2614(94)00898-1"},{"key":"ref118\/cit118","doi-asserted-by":"publisher","DOI":"10.1063\/1.1679012"},{"key":"ref119\/cit119","doi-asserted-by":"publisher","DOI":"10.1016\/0009-2614(93)87156-W"},{"key":"ref120\/cit120","doi-asserted-by":"publisher","DOI":"10.1063\/1.438728"},{"key":"ref121\/cit121","doi-asserted-by":"publisher","DOI":"10.1016\/0009-2614(93)89151-7"},{"key":"ref122\/cit122","doi-asserted-by":"publisher","DOI":"10.1063\/1.468148"},{"key":"ref123\/cit123","doi-asserted-by":"publisher","DOI":"10.1016\/S0009-2614(98)00862-8"},{"key":"ref124\/cit124","doi-asserted-by":"publisher","DOI":"10.1039\/b204199p"},{"key":"ref125\/cit125","doi-asserted-by":"publisher","DOI":"10.1063\/1.2370949"},{"key":"ref126\/cit126","doi-asserted-by":"publisher","DOI":"10.1063\/1.1564816"},{"key":"ref127\/cit127","doi-asserted-by":"publisher","DOI":"10.1002\/qua.560120408"},{"key":"ref128\/cit128","doi-asserted-by":"publisher","DOI":"10.1063\/1.2925269"},{"key":"ref129\/cit129","doi-asserted-by":"crossref","first-page":"e1692","DOI":"10.1002\/wcms.1692","volume":"14","author":"Pedersen T. B.","year":"2024","journal-title":"Wiley Interdiscip. Rev. Comput. Mol. Sci."},{"key":"ref130\/cit130","unstructured":"Jensen, F.\n                      Introduction to Computational Chemistry\n                      ; John wiley & sons, 2007; pp. 204\u2013208."},{"key":"ref131\/cit131","doi-asserted-by":"publisher","DOI":"10.1103\/RevModPhys.32.300"},{"key":"ref132\/cit132","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.540140615"},{"key":"ref133\/cit133","doi-asserted-by":"publisher","DOI":"10.1063\/1.456588"},{"key":"ref134\/cit134","doi-asserted-by":"publisher","DOI":"10.1103\/RevModPhys.35.457"},{"key":"ref135\/cit135","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.2c00261"},{"key":"ref136\/cit136","doi-asserted-by":"publisher","DOI":"10.1063\/1.1740588"},{"key":"ref137\/cit137","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.540100111"},{"key":"ref138\/cit138","doi-asserted-by":"publisher","DOI":"10.1063\/1.1696050"},{"key":"ref139\/cit139","doi-asserted-by":"publisher","DOI":"10.1002\/qua.560050839"},{"key":"ref140\/cit140","doi-asserted-by":"publisher","DOI":"10.1063\/1.1679283"},{"key":"ref141\/cit141","doi-asserted-by":"publisher","DOI":"10.1063\/1.430638"},{"key":"ref142\/cit142","doi-asserted-by":"publisher","DOI":"10.1016\/0009-2614(76)85390-0"},{"key":"ref143\/cit143","doi-asserted-by":"publisher","DOI":"10.1063\/1.433418"},{"key":"ref144\/cit144","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRev.46.618"},{"key":"ref145\/cit145","doi-asserted-by":"publisher","DOI":"10.1137\/07070111X"},{"key":"ref146\/cit146","doi-asserted-by":"publisher","DOI":"10.1063\/5.0071916"},{"key":"ref147\/cit147","doi-asserted-by":"publisher","DOI":"10.1063\/5.0004608"},{"key":"ref148\/cit148","doi-asserted-by":"publisher","DOI":"10.1016\/0009-2614(80)80396-4"},{"key":"ref149\/cit149","doi-asserted-by":"publisher","DOI":"10.1016\/0009-2614(86)80461-4"},{"key":"ref150\/cit150","doi-asserted-by":"publisher","DOI":"10.1063\/1.4936241"},{"key":"ref151\/cit151","doi-asserted-by":"publisher","DOI":"10.1080\/00268976.2020.1757774"},{"key":"ref152\/cit152","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.8b00286"},{"key":"ref153\/cit153","doi-asserted-by":"publisher","DOI":"10.1063\/5.0004837"},{"key":"ref154\/cit154","doi-asserted-by":"publisher","DOI":"10.1063\/5.0006002"},{"key":"ref155\/cit155","unstructured":"Turney, J.; Briggs, C. Einsums v 0.6.1, 2024. https:\/\/github.com\/Einsums\/Einsums."},{"key":"ref156\/cit156","unstructured":"Active Thermochemical Tables (ATcT) https:\/\/atct.anl.gov, 2026."},{"key":"ref157\/cit157","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.24854"},{"key":"ref158\/cit158","doi-asserted-by":"publisher","DOI":"10.1063\/1.3659142"},{"key":"ref159\/cit159","doi-asserted-by":"publisher","DOI":"10.1016\/j.cplett.2025.141874"},{"key":"ref160\/cit160","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jpca.2c01421"},{"key":"ref161\/cit161","doi-asserted-by":"publisher","DOI":"10.1038\/s41467-025-64104-8"},{"key":"ref162\/cit162","doi-asserted-by":"publisher","DOI":"10.1016\/j.cplett.2019.136810"},{"key":"ref163\/cit163","doi-asserted-by":"publisher","DOI":"10.1063\/5.0011674"},{"key":"ref164\/cit164","doi-asserted-by":"publisher","DOI":"10.1021\/jz101245s"},{"key":"ref165\/cit165","unstructured":"Computational Chemistry\nComparison and Benchmark DataBase (CCCBDB)\n                      . https:\/\/cccbdb.nist.gov\/, 2026."},{"key":"ref166\/cit166","doi-asserted-by":"publisher","DOI":"10.1038\/s41467-021-24119-3"},{"key":"ref167\/cit167","doi-asserted-by":"publisher","DOI":"10.1063\/5.0246763"},{"key":"ref168\/cit168","doi-asserted-by":"publisher","DOI":"10.1021\/ct400036b"},{"key":"ref169\/cit169","doi-asserted-by":"publisher","DOI":"10.1063\/1.5127550"},{"key":"ref170\/cit170","doi-asserted-by":"publisher","DOI":"10.1063\/1.4945444"},{"key":"ref171\/cit171","doi-asserted-by":"publisher","DOI":"10.1063\/1.4979993"},{"key":"ref172\/cit172","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jctc.4c00818"}],"container-title":["Journal of Chemical Theory and Computation"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jctc.5c01910","content-type":"application\/pdf","content-version":"vor","intended-application":"unspecified"},{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jctc.5c01910","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2026,3,24]],"date-time":"2026-03-24T08:10:42Z","timestamp":1774339842000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/acs.jctc.5c01910"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2026,3,6]]},"references-count":172,"journal-issue":{"issue":"6","published-print":{"date-parts":[[2026,3,24]]}},"alternative-id":["10.1021\/acs.jctc.5c01910"],"URL":"https:\/\/doi.org\/10.1021\/acs.jctc.5c01910","relation":{"has-preprint":[{"id-type":"doi","id":"10.26434\/chemrxiv-2025-qgc1q","asserted-by":"object"}]},"ISSN":["1549-9618","1549-9626"],"issn-type":[{"value":"1549-9618","type":"print"},{"value":"1549-9626","type":"electronic"}],"subject":[],"published":{"date-parts":[[2026,3,6]]}}}