{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2025,10,20]],"date-time":"2025-10-20T17:07:33Z","timestamp":1760980053494},"reference-count":36,"publisher":"Wiley","issue":"10","license":[{"start":{"date-parts":[[2004,9,7]],"date-time":"2004-09-07T00:00:00Z","timestamp":1094515200000},"content-version":"vor","delay-in-days":3629,"URL":"http:\/\/onlinelibrary.wiley.com\/termsAndConditions#vor"}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J Comput Chem"],"published-print":{"date-parts":[[1994,10]]},"abstract":"<jats:title>Abstract<\/jats:title><jats:p>The 22 possible valence isomers of the (CH)<jats:sub>8<\/jats:sub> and (SiH)<jats:sub>8<\/jats:sub> systems have been studied by <jats:italic>ab initio<\/jats:italic> molecular orbital calculations at the MP2\/6\u201031G*\/\/6\u201031G* + ZPE level. Optimized geometries, relative energies, and, for some selected compounds, vibrational frequencies are reported. The systematic differences between the carbon and silicon compounds are analyzed. \u00a9 1994 by John Wiley &amp; Sons, Inc.<\/jats:p>","DOI":"10.1002\/jcc.540151011","type":"journal-article","created":{"date-parts":[[2005,1,2]],"date-time":"2005-01-02T01:03:57Z","timestamp":1104627837000},"page":"1151-1162","source":"Crossref","is-referenced-by-count":13,"title":["The valence isomers of (CH)<sub>8<\/sub> and (SiH)<sub>8<\/sub>: An <i>ab initio<\/i> MO study"],"prefix":"10.1002","volume":"15","author":[{"given":"Uwe","family":"Versteeg","sequence":"first","affiliation":[]},{"given":"Wolfram","family":"Koch","sequence":"additional","affiliation":[]}],"member":"311","published-online":{"date-parts":[[2004,9,7]]},"reference":[{"key":"e_1_2_1_2_2","doi-asserted-by":"crossref","first-page":"185","DOI":"10.1021\/cr60276a004","volume":"72","author":"Scott L. T.","year":"1972","journal-title":"Chem. Rev."},{"key":"e_1_2_1_3_2","doi-asserted-by":"publisher","DOI":"10.1021\/cr60301a002"},{"key":"e_1_2_1_4_2","doi-asserted-by":"crossref","first-page":"5293","DOI":"10.1021\/ja00408a004","volume":"103","author":"Kollmar H.","year":"1981","journal-title":"J. Am. Chem. Soc."},{"key":"e_1_2_1_4_3","doi-asserted-by":"publisher","DOI":"10.1016\/0009-2614(89)87474-3"},{"key":"e_1_2_1_4_4","doi-asserted-by":"crossref","first-page":"100","DOI":"10.1070\/MC1993v003n03ABEH000242","author":"Glukhovtsev M. N.","year":"1993","journal-title":"Mendeleev Comuun"},{"key":"e_1_2_1_4_5","doi-asserted-by":"publisher","DOI":"10.1021\/ja00165a018"},{"key":"e_1_2_1_4_6","doi-asserted-by":"crossref","first-page":"4723","DOI":"10.1021\/ja00168a016","volume":"112","author":"Shriver G. W.","year":"1990","journal-title":"J. Am. Chem. Soc."},{"key":"e_1_2_1_5_2","volume-title":"Chemical Applications of Graph Theory","author":"Balaban A. T.","year":"1976"},{"key":"e_1_2_1_6_2","doi-asserted-by":"publisher","DOI":"10.1021\/ed061p766"},{"key":"e_1_2_1_7_2","doi-asserted-by":"publisher","DOI":"10.1021\/ed055p569"},{"key":"e_1_2_1_8_2","doi-asserted-by":"publisher","DOI":"10.1021\/cr00095a010"},{"key":"e_1_2_1_9_2","doi-asserted-by":"publisher","DOI":"10.1021\/ja00293a018"},{"key":"e_1_2_1_10_2","doi-asserted-by":"crossref","first-page":"2103","DOI":"10.1351\/pac198961122103","volume":"61","author":"Schulman J. M.","year":"1989","journal-title":"Pure Appl. Chem."},{"key":"e_1_2_1_11_2","doi-asserted-by":"crossref","unstructured":"(a)S.Nagase T.Kudo andM.Aoki J. Chem. Soc. Chem. Commun. 1121(1985);","DOI":"10.1039\/c39850001121"},{"key":"e_1_2_1_11_3","doi-asserted-by":"publisher","DOI":"10.1063\/1.452726"},{"key":"e_1_2_1_12_2","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.540090514"},{"key":"e_1_2_1_12_3","doi-asserted-by":"publisher","DOI":"10.1063\/1.450462"},{"key":"e_1_2_1_13_2","unstructured":"(a)H.Matsumoto K.Higuchi Y.Hoshino H.Koike Y.Naoi andY.Nagai J. Chem. Soc. Chem. Comm. 1083(1988);"},{"key":"e_1_2_1_13_3","doi-asserted-by":"publisher","DOI":"10.1002\/ange.19921041033"},{"key":"e_1_2_1_13_4","doi-asserted-by":"publisher","DOI":"10.1063\/1.106863"},{"key":"e_1_2_1_13_5","doi-asserted-by":"publisher","DOI":"10.1021\/ja00041a063"},{"key":"e_1_2_1_14_2","doi-asserted-by":"crossref","unstructured":"(a)S.Nagase M.Nakano andT.Kudo J. Chem. Soc. Chem. Comm. 60 (1987);","DOI":"10.1039\/c39870000060"},{"key":"e_1_2_1_14_3","doi-asserted-by":"publisher","DOI":"10.1002\/ange.19891010322"},{"key":"e_1_2_1_15_2","doi-asserted-by":"publisher","DOI":"10.1021\/ja00262a014"},{"key":"e_1_2_1_16_2","doi-asserted-by":"publisher","DOI":"10.1021\/ja00251a029"},{"key":"e_1_2_1_17_2","doi-asserted-by":"publisher","DOI":"10.1002\/0470025107.ch2"},{"key":"e_1_2_1_18_2","first-page":"269","volume":"15","author":"Pople J. A.","year":"1981","journal-title":"Int. J. Quant. Chem."},{"key":"e_1_2_1_18_3","doi-asserted-by":"publisher","DOI":"10.1002\/ijch.199300041"},{"key":"e_1_2_1_19_2","unstructured":"M. J. Frisch G. W. Trucks M. Head\u2010Gordon P. M. W. Gill M. W. Wong J. B. Foresman B. G. Johnson H. B. Schlegel M. A. Robb E. S. Replogle R. Gomperts J. L. Andres K. Raghavachari J. S. Binkley C. Gonzalez R. L. Martin D. J. Fox D. J. De Frees J. Baker J. J. P. Stewart J. A. Pople 1992 Gaussian Inc. Pittsburgh PA"},{"key":"e_1_2_1_20_2","unstructured":"Spartan version 2.0 Wavefunction Inc. Irvine CA 1992."},{"key":"e_1_2_1_21_2","doi-asserted-by":"publisher","DOI":"10.1002\/qua.560440876"},{"key":"e_1_2_1_22_2","doi-asserted-by":"publisher","DOI":"10.1021\/ja00267a063"},{"key":"e_1_2_1_23_2","doi-asserted-by":"publisher","DOI":"10.1002\/anie.199317601"},{"key":"e_1_2_1_24_2","doi-asserted-by":"publisher","DOI":"10.1002\/9780470125823.ch2"},{"key":"e_1_2_1_25_2","doi-asserted-by":"publisher","DOI":"10.1063\/1.456415"},{"key":"e_1_2_1_26_2","doi-asserted-by":"publisher","DOI":"10.1063\/1.460205"}],"container-title":["Journal of Computational Chemistry"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/api.wiley.com\/onlinelibrary\/tdm\/v1\/articles\/10.1002%2Fjcc.540151011","content-type":"unspecified","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/onlinelibrary.wiley.com\/doi\/pdf\/10.1002\/jcc.540151011","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,10,25]],"date-time":"2023-10-25T07:49:01Z","timestamp":1698220141000},"score":1,"resource":{"primary":{"URL":"https:\/\/onlinelibrary.wiley.com\/doi\/10.1002\/jcc.540151011"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[1994,10]]},"references-count":36,"journal-issue":{"issue":"10","published-print":{"date-parts":[[1994,10]]}},"alternative-id":["10.1002\/jcc.540151011"],"URL":"https:\/\/doi.org\/10.1002\/jcc.540151011","archive":["Portico"],"relation":{},"ISSN":["0192-8651","1096-987X"],"issn-type":[{"value":"0192-8651","type":"print"},{"value":"1096-987X","type":"electronic"}],"subject":[],"published":{"date-parts":[[1994,10]]}}}