Manganese promoter hinders carbon permeation on iron-based catalyst surfaces: A first-principles study
1Beijing Advanced Innovation Center for Materials Genome Engineering, Beijing Information Science and Technology University, Beijing 102206, China
2School of Computer Science, Beijing Information Science and Technology University, Beijing 102206, China
3State Key Laboratory of Coal Conversion, Institute of Coal Chemistry, Chinese Academy of Sciences, Taiyuan 030001, China
4University of Chinese Academy of Sciences, Beijing 100049, China
5National Energy Center for Coal to Liquids, Synfuels China Co., Ltd., Beijing 101400, China
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