Konu "Lithium hydride" için Fizik Bölümü listeleme
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Ab initio search for global minimum structures of neutral and anionic hydrogenated Li-5 clusters
(Elsevier Science Bv, 2013)The structure and some electronic properties of neutral and anionic Li5Hn (n = 0-6) clusters have been studied by using the stochastic search method with the B3LYP/6-31G level of theory. After searching possible isomers, ...