Отправить статью по E-mail Quantum-Chemical Analysis of the Electron Transfer Mechanism in Model System MgNbF7 + 12MgCl2 by the Method of Frontier Molecular Orbitals
- Авторы: Kremenetsky V.G.1, Kuznetsov S.A.1
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Учреждения:
- Tananaev Institute of Chemistry and Technology of Rare Elements and Mineral Raw Materials, Cola Science Center
- Выпуск: Том 54, № 9 (2018)
- Страницы: 676-682
- Раздел: Article
- URL: https://journals.rcsi.science/1023-1935/article/view/189466
- DOI: https://doi.org/10.1134/S1023193518090069
- ID: 189466
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Аннотация
By the example of quantum-chemical analysis of the model system MgNbF7 + 12MgCl2, the possibilities of the method of frontier molecular orbitals in studying the mechanism of electron transfer in molten salts are demonstrated. The rich information provided by this method allows recommending it as a tool for testing the hypotheses on the mechanism of charge transfer in electrochemical systems.
Об авторах
V. Kremenetsky
Tananaev Institute of Chemistry and Technology of Rare Elements and Mineral Raw Materials, Cola Science Center
Email: kuznet@chemy.kolasc.net.ru
Россия, Apatity, 184209
S. Kuznetsov
Tananaev Institute of Chemistry and Technology of Rare Elements and Mineral Raw Materials, Cola Science Center
Автор, ответственный за переписку.
Email: kuznet@chemy.kolasc.net.ru
Россия, Apatity, 184209
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