{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,3,26]],"date-time":"2026-03-26T03:16:36Z","timestamp":1774494996460,"version":"3.50.1"},"reference-count":63,"publisher":"American Chemical Society (ACS)","issue":"48","license":[{"start":{"date-parts":[[2019,11,8]],"date-time":"2019-11-08T00:00:00Z","timestamp":1573171200000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-029"},{"start":{"date-parts":[[2019,11,8]],"date-time":"2019-11-08T00:00:00Z","timestamp":1573171200000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-037"},{"start":{"date-parts":[[2019,11,8]],"date-time":"2019-11-08T00:00:00Z","timestamp":1573171200000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-045"}],"funder":[{"DOI":"10.13039\/100011264","name":"FP7 People: Marie-Curie Actions","doi-asserted-by":"publisher","award":["609033"],"award-info":[{"award-number":["609033"]}],"id":[{"id":"10.13039\/100011264","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100004901","name":"Funda??o de Amparo ? Pesquisa do Estado de Minas Gerais","doi-asserted-by":"publisher","award":["CEX - APQ-00071-15"],"award-info":[{"award-number":["CEX - APQ-00071-15"]}],"id":[{"id":"10.13039\/501100004901","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100003593","name":"Conselho Nacional de Desenvolvimento Cient?fico e Tecnol?gico","doi-asserted-by":"publisher","award":["403352\/2016-9"],"award-info":[{"award-number":["403352\/2016-9"]}],"id":[{"id":"10.13039\/501100003593","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100003593","name":"Conselho Nacional de Desenvolvimento Cient?fico e Tecnol?gico","doi-asserted-by":"publisher","award":["305469\/2018- 5"],"award-info":[{"award-number":["305469\/2018- 5"]}],"id":[{"id":"10.13039\/501100003593","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100002322","name":"Coordena??o de Aperfei?oamento de Pessoal de N?vel Superior","doi-asserted-by":"publisher","award":["001"],"award-info":[{"award-number":["001"]}],"id":[{"id":"10.13039\/501100002322","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Phys. Chem. A"],"published-print":{"date-parts":[[2019,12,5]]},"DOI":"10.1021\/acs.jpca.9b09309","type":"journal-article","created":{"date-parts":[[2019,11,8]],"date-time":"2019-11-08T16:51:13Z","timestamp":1573231873000},"page":"10454-10462","source":"Crossref","is-referenced-by-count":19,"title":["What Electronic Structure Method Can Be Used in the Global Optimization of Nanoclusters?"],"prefix":"10.1021","volume":"123","author":[{"ORCID":"https:\/\/orcid.org\/0000-0002-4184-2437","authenticated-orcid":true,"given":"Breno R. L.","family":"Galv\u00e3o","sequence":"first","affiliation":[{"name":"Centro Federal de Educa\u00e7\u00e3o Tecnol\u00f3gica de Minas Gerais, CEFET-MG, Av. Amazonas 5253, 30421-169 Belo Horizonte, Minas Gerais, Brazil"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-2312-990X","authenticated-orcid":true,"given":"Lu\u00eds P.","family":"Viegas","sequence":"additional","affiliation":[{"name":"Aarhus Institute of Advanced Studies, Aarhus University, Aarhus DK-8000, Denmark"}]}],"member":"316","published-online":{"date-parts":[[2019,11,8]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"publisher","DOI":"10.1038\/nnano.2015.140"},{"key":"ref2\/cit2","doi-asserted-by":"publisher","DOI":"10.3390\/ijms19124031"},{"key":"ref3\/cit3","doi-asserted-by":"publisher","DOI":"10.1063\/1.4901109"},{"key":"ref4\/cit4","doi-asserted-by":"publisher","DOI":"10.1021\/jp970984n"},{"key":"ref5\/cit5","doi-asserted-by":"publisher","DOI":"10.1039\/b305686d"},{"key":"ref6\/cit6","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jpca.9b05601"},{"key":"ref7\/cit7","doi-asserted-by":"publisher","DOI":"10.1063\/1.1783276"},{"key":"ref8\/cit8","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevB.73.125431"},{"key":"ref9\/cit9","doi-asserted-by":"publisher","DOI":"10.1063\/1.3299292"},{"key":"ref10\/cit10","doi-asserted-by":"publisher","DOI":"10.1080\/00268970903446756"},{"key":"ref11\/cit11","doi-asserted-by":"publisher","DOI":"10.1063\/1.3403692"},{"key":"ref12\/cit12","doi-asserted-by":"publisher","DOI":"10.1021\/jp304321u"},{"key":"ref13\/cit13","doi-asserted-by":"publisher","DOI":"10.1039\/C1NR11053E"},{"key":"ref14\/cit14","doi-asserted-by":"publisher","DOI":"10.1039\/c2cp41066d"},{"key":"ref15\/cit15","doi-asserted-by":"publisher","DOI":"10.1063\/1.4717708"},{"key":"ref16\/cit16","doi-asserted-by":"publisher","DOI":"10.1039\/c3cp52160e"},{"key":"ref17\/cit17","doi-asserted-by":"publisher","DOI":"10.1002\/qua.24462"},{"key":"ref18\/cit18","doi-asserted-by":"publisher","DOI":"10.1063\/1.4872369"},{"key":"ref19\/cit19","doi-asserted-by":"publisher","DOI":"10.1039\/C4CP01825G"},{"key":"ref20\/cit20","doi-asserted-by":"publisher","DOI":"10.1063\/1.4863443"},{"key":"ref21\/cit21","doi-asserted-by":"publisher","DOI":"10.1039\/C6NR02080A"},{"key":"ref22\/cit22","doi-asserted-by":"publisher","DOI":"10.1039\/c6cp05605a"},{"key":"ref23\/cit23","doi-asserted-by":"publisher","DOI":"10.1007\/s00894-018-3724-6"},{"key":"ref24\/cit24","doi-asserted-by":"publisher","DOI":"10.1016\/S0009-2614(89)87395-6"},{"key":"ref25\/cit25","doi-asserted-by":"publisher","DOI":"10.1016\/S0010-4655(02)00598-2"},{"key":"ref26\/cit26","doi-asserted-by":"publisher","DOI":"10.1016\/j.cpc.2007.03.001"},{"key":"ref27\/cit27","doi-asserted-by":"publisher","DOI":"10.1021\/ct600366k"},{"key":"ref28\/cit28","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRev.46.618"},{"key":"ref29\/cit29","doi-asserted-by":"publisher","DOI":"10.1063\/1.1367373"},{"key":"ref30\/cit30","doi-asserted-by":"publisher","DOI":"10.1063\/1.448799"},{"key":"ref31\/cit31","doi-asserted-by":"publisher","DOI":"10.1063\/1.448800"},{"key":"ref32\/cit32","doi-asserted-by":"publisher","DOI":"10.1063\/1.448975"},{"key":"ref33\/cit33","doi-asserted-by":"publisher","DOI":"10.1063\/1.1569242"},{"key":"ref34\/cit34","doi-asserted-by":"publisher","DOI":"10.1063\/1.1809602"},{"key":"ref35\/cit35","doi-asserted-by":"publisher","DOI":"10.1063\/1.3465551"},{"key":"ref36\/cit36","doi-asserted-by":"publisher","DOI":"10.1063\/1.2741259"},{"key":"ref37\/cit37","doi-asserted-by":"publisher","DOI":"10.1063\/1.4903193"},{"key":"ref38\/cit38","doi-asserted-by":"publisher","DOI":"10.1007\/s00214-016-2016-4"},{"key":"ref39\/cit39","doi-asserted-by":"publisher","DOI":"10.1063\/1.1626543"},{"key":"ref40\/cit40","doi-asserted-by":"publisher","DOI":"10.1063\/1.464913"},{"key":"ref41\/cit41","doi-asserted-by":"publisher","DOI":"10.1021\/j100096a001"},{"key":"ref42\/cit42","doi-asserted-by":"publisher","DOI":"10.1016\/S0009-2614(97)00207-8"},{"key":"ref43\/cit43","doi-asserted-by":"publisher","DOI":"10.1016\/S0009-2614(98)01201-9"},{"key":"ref44\/cit44","doi-asserted-by":"publisher","DOI":"10.1063\/1.478522"},{"key":"ref45\/cit45","doi-asserted-by":"publisher","DOI":"10.1007\/s00214-007-0310-x"},{"key":"ref46\/cit46","doi-asserted-by":"publisher","DOI":"10.1039\/b810189b"},{"key":"ref47\/cit47","unstructured":"Perdew, J. P.; Schmidt, K. Density functional theory and its application to materials; Van Doren, V., Van Alsenoy, C., Geerlings, P., Eds. AIP: Melville, NY, 2001; pp 1\u201320."},{"key":"ref48\/cit48","doi-asserted-by":"publisher","DOI":"10.1063\/1.1904565"},{"key":"ref49\/cit49","doi-asserted-by":"publisher","DOI":"10.1021\/ct401026a"},{"key":"ref50\/cit50","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.540141112"},{"key":"ref51\/cit51","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jpca.8b08970"},{"key":"ref52\/cit52","doi-asserted-by":"publisher","DOI":"10.1063\/1.3231134"},{"key":"ref53\/cit53","doi-asserted-by":"publisher","DOI":"10.1021\/ci100219f"},{"key":"ref54\/cit54","doi-asserted-by":"publisher","DOI":"10.1016\/j.cplett.2015.09.016"},{"key":"ref55\/cit55","doi-asserted-by":"publisher","DOI":"10.1039\/C8CP03233E"},{"key":"ref56\/cit56","doi-asserted-by":"publisher","DOI":"10.1002\/wcms.1110"},{"key":"ref57\/cit57","doi-asserted-by":"publisher","DOI":"10.1002\/wcms.30"},{"key":"ref58\/cit58","doi-asserted-by":"publisher","DOI":"10.1016\/0009-2614(96)00636-7"},{"key":"ref59\/cit59","doi-asserted-by":"publisher","DOI":"10.1126\/science.277.5328.928"},{"key":"ref60\/cit60","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevLett.52.2141"},{"key":"ref61\/cit61","doi-asserted-by":"publisher","DOI":"10.1021\/jp020887g"},{"key":"ref62\/cit62","doi-asserted-by":"publisher","DOI":"10.1021\/j100005a009"},{"key":"ref63\/cit63","doi-asserted-by":"publisher","DOI":"10.1007\/s004600050079"}],"container-title":["The Journal of Physical Chemistry A"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jpca.9b09309","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,4,15]],"date-time":"2023-04-15T16:44:34Z","timestamp":1681577074000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/acs.jpca.9b09309"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2019,11,8]]},"references-count":63,"journal-issue":{"issue":"48","published-print":{"date-parts":[[2019,12,5]]}},"alternative-id":["10.1021\/acs.jpca.9b09309"],"URL":"https:\/\/doi.org\/10.1021\/acs.jpca.9b09309","relation":{},"ISSN":["1089-5639","1520-5215"],"issn-type":[{"value":"1089-5639","type":"print"},{"value":"1520-5215","type":"electronic"}],"subject":[],"published":{"date-parts":[[2019,11,8]]}}}