Xu Wei-Hong, Meng Qiang-Qiang, Gao Chao, Wang Jing, Li Qun-Xiang, Liu Jin-Huai, Huang Xing-Jiu
Research Center for Biomimetic Functional Materials and Sensing Devices, Institute of Intelligent Machines, Chinese Academy of Sciences, Hefei, 230031, P. R. China.
Chem Commun (Camb). 2014 May 21;50(39):5011-3. doi: 10.1039/c4cc01029a. Epub 2014 Apr 7.
We find for the first time that the electrochemical performances of the α-Fe2O3 nanostructures depend on their exposed facets. Density functional theory calculations are carried out to better and scientifically understand the effect of different exposed facets at the atomic-scale level.
我们首次发现α-Fe₂O₃纳米结构的电化学性能取决于其暴露的晶面。进行了密度泛函理论计算,以便在原子尺度水平上更好、更科学地理解不同暴露晶面的影响。