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Thermochemical stabilities,electronic structures,and optical properties of C56X10 (X = H,F, and Cl) fullerene compounds |
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| Authors: | Shu‐Wei Tang Jing‐Dong Feng Yong‐Qing Qiu Hao Sun Feng‐Di Wang Zhong‐Min Su Ying‐Fei Chang Rong‐Shun Wang |
| Affiliation: | Institute of Functional Material Chemistry, Faculty of Chemistry, Northeast Normal University, Changchun, Jilin 130024, People's Republic of China |
| Abstract: | |
| Keywords: | density functional theory (DFT) nonlinear optical (NLO) property finite field (FF) electronic structures thermochemistry |