Theoretical studies on a carbonaceous molecular bearing: association thermodynamics and dual-mode rolling dynamics
2015; Royal Society of Chemistry; Volume: 6; Issue: 5 Linguagem: Inglês
10.1039/c5sc00335k
ISSN2041-6539
AutoresHiroyuki Isobe, Kôsuke Nakamura, Shunpei Hitosugi, Sota Sato, Hiroaki Tokoyama, Hideo Yamakado, Koichi Ohno, Hirohiko Kono,
Tópico(s)Nonlinear Optical Materials Research
ResumoThe dynamics of a carbonaceous molecular bearing were investigated by DFT methods to reveal dual-mode motions with a minute energy barrier.
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