Порівняльна квантовохімічна оцінка процесів літіювання/делітіювання в нанокластерах Sin та нанокомпозитах CmSin

A comparative quantum chemical (РМ3 method) examination has been carried out of lithiation/delithiation processes in Sin nanoclusters and СmSin nanocomposites. These processes in the nanocomposites (25 and ~30% С, respectively) have been shown to effect slightly on the volumes and structures of init...

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Bibliographic Details
Date:2015
Main Authors: Kartel, M. T., Kuts, V. S., Grebenyuk, A. G., Tarasenko, Yu. А.
Format: Article
Language:English
Published: Chuiko Institute of Surface Chemistry National Academy of Sciences of Ukraine 2015
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Online Access:https://www.cpts.com.ua/index.php/cpts/article/view/313
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Journal Title:Chemistry, Physics and Technology of Surface

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Chemistry, Physics and Technology of Surface