Аннотация:
Density-functional theory (DFT) calculations at B3LYP/6-311+G(df,p) and M06/6-311+G(df,p) levels of theory predict the stability of new polynuclear sandwich complexes [Cu5(C10H10)2]+ and Ni5(C10H10)2 based on flat [10]annulene cycles.
Образец цитирования:
T. N. Gribanova, R. M. Minyaev, V. I. Minkin, “Polynuclear sandwich derivatives of [10]annulene: A quantum chemical study”, Mendeleev Commun., 33:3 (2023), 302–305
Образцы ссылок на эту страницу:
https://www.mathnet.ru/rus/mendc379
https://www.mathnet.ru/rus/mendc/v33/i3/p302
Эта публикация цитируется в следующих 4 статьяx:
A. M. Toikka, A. V. Petrov, “Alternativeness of ester synthesis reaction mechanism: a case study of propyl acetate”, Mendeleev Commun., 34:1 (2024), 134–136
T. N. Gribanova, R. M. Minyaev, V. I. Minkin, “BeO analogues of annulated cyclooctatetraene and cyclodecapentaene as new inorganic species with unusual multiple hypervalent O∙∙∙O interactions”, Mendeleev Commun., 34:6 (2024), 798–801
S. Yu. Ketkov, “Electronic structures of transition metal sandwich complexes revisited by high-resolution laser spectroscopy coupled with DFT”, Mendeleev Commun., 34:3 (2024), 307–315
I. V. Polyakov, K. D. Miroshnichenko, T. I. Mulashkina, A. A. Moskovsky, E. I. Marchenko, M. G. Khrenova, “Towards accurate machine learning predictions of properties
of the P–O bond cleaving in ATP upon enzymatic hydrolysis”, Mendeleev Commun., 34:6 (2024), 776–779
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