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Natalia G. Vnukova

Siberian Federal University - Institute of Engineering Physics and Radio Electronics

Krasnoyarsk

Russia

  • Siberian Federal University - Institute of Engineering Physics and Radio Electronics

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Insights into Fullerene Polymerization Under the High Pressure: The Role of Endohedral Sc Dimer

Number of pages: 19 Posted: 15 Nov 2021
Sergey Vladimirovich Erohin, Valentin D. Churkin, Natalia G. Vnukova, Maxim A. Visotin, E. A. Kovaleva, Vladlen V. Zhukov, Liubov Yu. Antipina, Ye. V. Tomashevich, Yu. L. Michlin, Mikhail Yu. Popov, G. N. Churilov, Pavel B. Sorokin and Aleksandr S. Fedorov
Technological Institute for Superhard and Novel Carbon Materials, Technological Institute for Superhard and Novel Carbon Materials, Siberian Federal University - Institute of Engineering Physics and Radio Electronics, Siberian Federal University - Institute of Engineering Physics and Radio Electronics, Russian Academy of Sciences (RAS) - Kirensky Institute of Physics, Technological Institute for Superhard and Novel Carbon Materials, Russian Academy of Sciences (RAS) - N.M. Emanuel Institute of Biochemical Physics, Russian Academy of Sciences (RAS) - Institute of Chemistry and Chemical Technology, Russian Academy of Sciences (RAS) - Institute of Chemistry and Chemical Technology, Technological Institute for Superhard and Novel Carbon Materials, Siberian Federal University - Institute of Engineering Physics and Radio Electronics, Technological Institute for Superhard and Novel Carbon Materials and Siberian Federal University - Institute of Engineering Physics and Radio Electronics
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Abstract:

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endohedral metallofullerenes, fullerite, pressure induced phase transformation, density functional theory, density functional based tight binding