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Prog."},{"key":"ci600206kb00029\/ci600206kb00029_1","volume-title":"the geometry of LJ85 with the energy of + 0.994 changed to the global-minimum one by moving the third highest-energy atom where denotes the global-minimum energy of LJ85","author":"For"},{"key":"ci600206kb00030\/ci600206kb00030_1","doi-asserted-by":"crossref","first-page":"75","DOI":"10.1016\/j.chemphys.2004.06.032","volume":"305","author":"Shao X.","year":"2004","journal-title":"Chem. Phys."},{"key":"ci600206kb00031\/ci600206kb00031_1","unstructured":"Energy values slightly lower than those reported in refs 1\u22129 were obtained for the following clusters:\u2009E(LJ243) = \u22121529.712151(5),E(LJ358) = \u22122348.782315(5),E(LJ361) = \u22122370.445427(10),E(LJ362) = \u22122377.676606(8),E(LJ364) = \u22122391.887487(4),E(LJ365) = \u22122398.871608(5),E(LJ366) = \u22122406.102774(5),E(LJ407) = \u22122704.203479(9),E(LJ409) = \u22122718.677731(10),E(LJ410) = \u22122725.907425(4),E(LJ411) = \u22122733.137602(3),E(LJ413) = \u22122747.363773(7),E(LJ416) = \u22122768.583578(9),E(LJ417) = \u22122775.814039(3),E(LJ418) = \u22122782.294096(6),E(LJ552) = \u22123777.120254(3),E(LJ553) = \u22123784.372712(7),E(LJ554) = \u22123791.625175(10),E(LJ555) = \u22123798.877768(9),E(LJ557) = \u22123813.382827(7), andE(LJ558) = \u22123820.635426(11), where numbers in parentheses denote differences from data in the above references referring to the last significant digit."}],"container-title":["Journal of Chemical Information and Modeling"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/ci600206k","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,3,23]],"date-time":"2023-03-23T23:41:29Z","timestamp":1679614889000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/ci600206k"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2006,7,28]]},"references-count":28,"journal-issue":{"issue":"5","published-print":{"date-parts":[[2006,9,1]]}},"alternative-id":["10.1021\/ci600206k"],"URL":"https:\/\/doi.org\/10.1021\/ci600206k","relation":{},"ISSN":["1549-9596","1549-960X"],"issn-type":[{"value":"1549-9596","type":"print"},{"value":"1549-960X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2006,7,28]]}}}