Blar i NTNU Open på forfatter "Feng, Xiang"
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Towards high activity of hydrogen production from ammonia borane over efficient non-noble Ni5P4 catalyst
Feng, Xiang; Zhao, Yuhai; Liu, Dakuo; Mo, Yasi; Liu, Yibin; Chen, Xiaobo; Yan, Wenjuan; Jin, Xin; Chen, Bingxu; Duan, Xuezhi; Chen, De; Yang, Chaohe (Journal article; Peer reviewed, 2018)Catalytic hydrolysis of ammonia borane has tremendous potential as an energy-efficient approach to supply hydrogen for energy vehicles and portable electronic devices. Herein, DFT calculation is first performed on electronic ... -
Towards rational catalyst design: boosting the rapid prediction of transition-metal activity by improved scaling relations
Wang, Yalan; Xiao, Ling; Qi, Yanying; Mahmoodinia, Mehdi; Feng, Xiang; Yang, Jia; Zhu, Yi-An; Chen, De (Peer reviewed; Journal article, 2019)Understanding the scaling relations of adsorption energies and activation energies greatly facilitates the computational catalyst design. To reduce the computational cost and guarantee efficiency, improved scaling relations ...