Email this article Charge characteristics of structurally complex titanocene by the NBO method
- Authors: Loukova G.V.1, Milov A.A.2
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Affiliations:
- Federal Research Center of Problems of Chemical Physics and Medicinal Chemistry, RAS
- Southern Scientific Center, RAS
- Issue: Vol 59, No 1 (2025)
- Pages: 69-72
- Section: ПИСЬМА В РЕДАКЦИЮ
- URL: https://cardiosomatics.ru/0023-1193/article/view/684671
- DOI: https://doi.org/10.31857/S0023119325010097
- EDN: https://elibrary.ru/SOYEJH
- ID: 684671
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About the authors
G. V. Loukova
Federal Research Center of Problems of Chemical Physics and Medicinal Chemistry, RAS
Author for correspondence.
Email: gloukova@mail.ru
Russian Federation, Chernogolovka
A. A. Milov
Southern Scientific Center, RAS
Email: gloukova@mail.ru
Russian Federation, Rostov-on-Don
References
- Лукова Г.В., Милов А.А. // Химия высоких энергий. 2023. Т. 57. С. 437.
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- Loukova G.V. Springer Handbook of Inorganic Photochemistry. Chapter 19 / Eds.: D. Bahnemann, A.O.T. Patrocinio. Springer Handbooks. Cham: Springer, 2022. P. 459.
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- Loukova G.V., Vasiliev V.P., Milov A.A., Smirnov V.A., Minkin V.I. // J. Photochem. Photobiol. A: Chem. 2016. V. 327. P. 6.
- Loukova G.V., Milov A.A., Vasiliev V.P., Minkin V.I. // Phys. Chem. Chem. Phys. 2016. V. 18. P. 17822.
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Fig. 1. Optimized structure of titanocene dicarboranyl in the S0 state.
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