Computational analysis of strain-induced effects on the dynamic properties of C60 in fullerite
A hybrid discrete-continuous physical and mathematical model is used to study what deformation characteristics cause the rolling effect of C-60 fullerene in a fullerite crystal. The interaction of fullerene atoms with surrounding molecules is described using a centrally symmetric interaction potenti...
| Published in: | Crystals Vol. 12, № 2. P. 260 (1-12) |
|---|---|
| Other Authors: | , , , |
| Format: | Article |
| Language: | English |
| Subjects: | |
| Online Access: | http://vital.lib.tsu.ru/vital/access/manager/Repository/koha:001002844 Перейти в каталог НБ ТГУ |
| LEADER | 02211nab a2200373 c 4500 | ||
|---|---|---|---|
| 001 | koha001002844 | ||
| 005 | 20230608135326.0 | ||
| 007 | cr | | ||
| 008 | 230602|2022 sz s a eng d | ||
| 024 | 7 | |a 10.3390/cryst12020260 |2 doi | |
| 035 | |a koha001002844 | ||
| 040 | |a RU-ToGU |b rus |c RU-ToGU | ||
| 245 | 1 | 0 | |a Computational analysis of strain-induced effects on the dynamic properties of C60 in fullerite |c A. V. Lun-Fu, A. M. Bubenchikov, M. A. Bubenchikov, V. A. Ovchinnikov |
| 336 | |a Текст | ||
| 337 | |a электронный | ||
| 504 | |a Библиогр.: 51 назв. | ||
| 520 | 3 | |a A hybrid discrete-continuous physical and mathematical model is used to study what deformation characteristics cause the rolling effect of C-60 fullerene in a fullerite crystal. The interaction of fullerene atoms with surrounding molecules is described using a centrally symmetric interaction potential, in which the surrounding molecules are considered as a spherical surface of uniformly distributed carbon atoms. The rotational motion of fullerene is described by the Euler dynamic equations. The results of a numerical study of the influence of the rate, magnitude, and direction of strain on the dynamic characteristics of the rotational and translational motion of C-60 fullerene in a crystalline fragment are presented. | |
| 653 | |a молекулярные кристаллы | ||
| 653 | |a фуллерены | ||
| 653 | |a фуллериты | ||
| 653 | |a скорость деформации | ||
| 653 | |a физико-математические модели | ||
| 655 | 4 | |a статьи в журналах |9 887732 | |
| 700 | 1 | |a Lun-Fu, Aleksandr V. |9 809053 | |
| 700 | 1 | |a Bubenchikov, Alexey M. |9 97674 | |
| 700 | 1 | |a Bubenchikov, Mikhail A. |9 97673 | |
| 700 | 1 | |a Ovchinnikov, Vyacheslav A. |9 480066 | |
| 773 | 0 | |t Crystals |d 2022 |g Vol. 12, № 2. P. 260 (1-12) |x 2073-4352 | |
| 852 | 4 | |a RU-ToGU | |
| 856 | 4 | |u http://vital.lib.tsu.ru/vital/access/manager/Repository/koha:001002844 | |
| 856 | |y Перейти в каталог НБ ТГУ |u https://koha.lib.tsu.ru/cgi-bin/koha/opac-detail.pl?biblionumber=1002844 | ||
| 908 | |a статья | ||
| 039 | |z 21 |b 100 | ||
| 999 | |c 1002844 |d 1002844 | ||