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Structural and Spectral Properties of a Nonclassical C(66) Isomer with Its Hydrogenated Derivative C(66)H(4) in Theory

[Image: see text] X-ray photoelectron and near-edge X-ray absorption fine structure (NEXAFS) spectra, as well as the ground-state electronic/geometrical structures of a newly discovered nonclassical isomer C(2v)-C(66)(NC), and two classical fullerene isomers C(2)-(#4466)C(66) and C(s)-(#4169)C(66) w...

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Detalles Bibliográficos
Autores principales: Mao, Renfeng, Wang, Ziwei, Song, Xiaoxi, Chen, Wen-Kai, Qi, Jiayuan
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2021
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8529658/
https://www.ncbi.nlm.nih.gov/pubmed/34693130
http://dx.doi.org/10.1021/acsomega.1c03691

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