催化作用
质子交换膜燃料电池
化学
可逆氢电极
氧气
金属
吸附
产量(工程)
过渡金属
密度泛函理论
无机化学
材料科学
电化学
物理化学
计算化学
电极
有机化学
冶金
参比电极
作者
Feng Ma,Xuan Liu,Xiaoming Wang,Jiashun Liang,Jianyu Huang,Cameron Priest,Jinjia Liu,Shuhong Jiao,Tanyuan Wang,Gang Wu,Yunhui Huang,Qing Li
标识
DOI:10.1016/j.fmre.2022.03.008
摘要
yield. X-ray adsorption spectroscopy (XAS) and density functional theory (DFT) calculations suggest the more negative formation energy (by 1.2 eV) and increased charge transfer of Zn-Co dual-site structure compared to Co-N-C could strength the Co-N bonds against the demetalation and the optimized d-band center accounts for the improved ORR kinetics.
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