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Active-Site Computational Screening: Role of Structural and Compositional Diversity for the Electrochemical CO2 Reduction at Mo Carbide Catalysts

机译：有源网站计算筛选：结构和组成多样性在Mo碳化物催化剂的电化学二氧化碳减少的作用

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1. Active-Site Computational Screening: Role of Structural and Compositional Diversity for the Electrochemical CO2 Reduction at Mo Carbide Catalysts [J] . Haobo Li, Karsten Reuter ACS catalysis . 2020,第20期

机译：有效现场计算筛选：结构和组成多样性在Mo碳化物催化剂的电化学二氧化碳减少的作用
2. Electrocatalytic CO2 reduction by M(bpy-R)(CO)_4 (M = Mo, W; R = H, tBu) complexes. Electrochemical, spectroscopic, and computational studies and comparison with group 7 catalysts [J] . Melissa L. Clark, Kyle A. Grice, Curtis E. Moore Chemical science . 2014,第5期

机译：M（bpy-R）（CO）_4（M = Mo，W; R = H，tBu）配合物的电催化CO2还原。电化学，光谱和计算研究，并与第7组催化剂进行比较
3. Computational screening of homo and hetero transition metal dimer catalysts for reduction of CO2 to C-2 products with high activity and low limiting potential [J] . Chen Dachang, Chen Zhiwen, Lu Zhuole, Journal of Materials Chemistry, A. Materials for energy and sustainability . 2020,第40期

机译：同源和异质过渡金属二聚体催化剂的计算筛选，用于减少具有高活性和低限制电位的CO 2至C-2产物
4. FUNCTIONAL ROLE OF PYRIDINIUM BRONSTED ACID CATALYSTS DURING ELECTROCHEMICAL REDUCTION OF CO2 ON Pt(111) [C] . C. Moyses Araujo, Steven J. Konezny, Victor S. Batista National Meeting Exhibition . 2012

机译：吡啶铜酮酸催化剂在PT（111）上电化学减少过程中的功能作用
5. Computational Screening of Transition Metal/p-Block Materials for Electrochemical Reduction of CO2 [D] . Ananthaneni, Sahithi. 2020

机译：过渡金属/ P嵌段材料的计算筛选CO2电化学减少
6. Cu metal embedded in oxidized matrix catalyst to promote CO2 activation and CO dimerization for electrochemical reduction of CO2 [O] . Hai Xiao, William A. Goddard III, Tao Cheng, 2017

机译：嵌入氧化基质催化剂中的铜金属可促进CO2活化和CO二聚作用以电化学还原CO2
7. Electrocatalytic CO2 reduction by M(bpy-R)(CO)4 (M = Mo, W; R = H, tBu) complexes. Electrochemical, spectroscopic, and computational studies and comparison with group 7 catalysts [O] . Melissa L. Clark, Kyle A. Grice, Curtis E. Moore, 2014

机译：通过M（BPY-R）（CO）4（CO）4（M = MO，W; r = H，TBU）复合物减少电催化CO 2。电化学，光谱和计算研究与7组催化剂的比较

Active-Site Computational Screening: Role of Structural and Compositional Diversity for the Electrochemical CO2 Reduction at Mo Carbide Catalysts

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