化学
密度泛函理论
计算化学
图书馆学
计算机科学
标识
DOI:10.1016/j.ccr.2014.02.023
摘要
This article has been retracted: please see Elsevier Policy on Article Withdrawal (https://www.elsevier.com/about/our-business/policies/article-withdrawal). This review article has been retracted at the request of the Editors. It was brought to the attention of the Editor-in-Chief that large sections of the text in the Review Article are plagiarised from many previously published articles, book chapters and various internet resources. Some examples are listed below: 1) Nuclear magnetic resonance shielding constants and chemical shifts in linear 199Hg compounds: A comparison of three relativistic computational method Vaida Arcisauskaite, Juan I. Melo, Lars Hemmingsen and Stephan P. A. Sauer, J. Chem. Phys. 135, 044306 (2011); https://doi.org/10.1063/1.3608153 2) Theoretical Studies on the Photoelectron and Absorption Spectra of MnO and TcO. Jing Su, Wen-Hua Xu, Chao-Fei Xu, W. H. E. Schwarz, Jun Li, Inorg. Chem. 2013, 52, 17, 9867–9874; https://doi.org/10.1021/ic4009625 3) Probing the Solvent Shell with 195Pt Chemical Shifts: Density Functional Theory Molecular Dynamics Study of PtII and PtIV Anionic Complexes in Aqueous Solution Lionel A. Tru?andier and Jochen Autschbach, J. Am. Chem. Soc. 2010, 132, 10, 3472–3483; https://doi.org/10.1021/ja9096863 One of the conditions of submission of a paper for publication is that authors declare explicitly that their work is original and has not appeared in a publication elsewhere. Re-use of any data should be appropriately cited. Apologies are offered to readers of the journal that this was not detected during the submission process.
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