DFT study of the oxygen reduction reaction on iron, cobalt and manganese macrocycle active sites
暂无分享,去创建一个
[1] Q. Xie,et al. Facile Synthesis of Manganese‐Oxide‐Containing Mesoporous Nitrogen‐Doped Carbon for Efficient Oxygen Reduction , 2012 .
[2] Xiayan Wang,et al. DFT Study of Polyaniline and Metal Composites as Nonprecious Metal Catalysts for Oxygen Reduction in Fuel Cells , 2012 .
[3] Yanguang Li,et al. Engineering manganese oxide/nanocarbon hybrid materials for oxygen reduction electrocatalysis , 2012, Nano Research.
[4] K. K. Maniam,et al. Effect of pyrolysis temperature on cobalt phthalocyanine supported on carbon nanotubes for oxygen reduction reaction , 2012, Journal of Applied Electrochemistry.
[5] Rongrong Chen,et al. Molecular and Electronic Structures of Transition-Metal Macrocyclic Complexes as Related to Catalyzing Oxygen Reduction Reactions: A Density Functional Theory Study , 2012 .
[6] W. Orellana. Metal-phthalocyanine functionalized carbon nanotubes as catalyst for the oxygen reduction reaction: A theoretical study , 2012 .
[7] Xiayan Wang,et al. Density Functional Theory Study of the Oxygen Reduction Reaction on a Cobalt–Polypyrrole Composite Catalyst , 2012 .
[8] F. Harnisch,et al. Enhanced Activity of Non‐Noble Metal Electrocatalysts for the Oxygen Reduction Reaction Using Low Temperature Plasma Treatment , 2011 .
[9] Jan Rossmeisl,et al. Density functional studies of functionalized graphitic materials with late transition metals for Oxygen Reduction Reactions. , 2011, Physical chemistry chemical physics : PCCP.
[10] Sam F. Y. Li,et al. Carbon nanotube supported MnO₂ catalysts for oxygen reduction reaction and their applications in microbial fuel cells. , 2011, Biosensors & bioelectronics.
[11] Juan Herranz,et al. Iron-based cathode catalyst with enhanced power density in polymer electrolyte membrane fuel cells. , 2011, Nature communications.
[12] T. Kondo,et al. Investigation of macromolecule–metal complexes as cathode catalyst in polymer electrolyte membrane fuel cell system , 2011 .
[13] Zhen Yao,et al. Facile construction of manganese oxide doped carbon nanotube catalysts with high activity for oxygen reduction reaction and investigations into the origin of their activity enhancement. , 2011, ACS applied materials & interfaces.
[14] Gang Wu,et al. High-Performance Electrocatalysts for Oxygen Reduction Derived from Polyaniline, Iron, and Cobalt , 2011, Science.
[15] Branko N. Popov,et al. Studies of oxygen reduction reaction active sites and stability of nitrogen-modified carbon composite catalysts for PEM fuel cells , 2010 .
[16] Frédéric Jaouen,et al. Iron-Based Catalysts with Improved Oxygen Reduction Activity in Polymer Electrolyte Fuel Cells , 2009, Science.
[17] Sebastian Fiechter,et al. Nature of the Catalytic Centers of Porphyrin-Based Electrocatalysts for the ORR: A Correlation of Kinetic Current Density with the Site Density of Fe−N4 Centers , 2008 .
[18] Rongrong Chen,et al. Density functional theory study of the adsorption of oxygen molecule on iron phthalocyanine and cobalt phthalocyanine , 2008 .
[19] Reyimjan A. Sidik,et al. Oxygen Electroreduction on FeII and FeIII Coordinated to N4 Chelates. Reversible Potentials for the Intermediate Steps from Quantum Theory , 2004 .
[20] S. Marcotte,et al. Oxygen Reduction Catalysts for Polymer Electrolyte Fuel Cells from the Pyrolysis of Iron Acetate Adsorbed on Various Carbon Supports , 2003 .
[21] A. Becke. Density-functional thermochemistry. III. The role of exact exchange , 1993 .
[22] Sam F. Y. Li,et al. Manganese–polypyrrole–carbon nanotube, a new oxygen reduction catalyst for air-cathode microbial fuel cells , 2013 .
[23] S. Yen,et al. Vitalizing fuel cells with vitamins: pyrolyzed vitamin B12 as a non-precious catalyst for enhanced oxygen reduction reaction of polymer electrolyte fuel cells , 2012 .
[24] Haijiang Wang,et al. Electrochemical Performance of Carbon-Supported Co-Phthalocyanine Modified with Co-Added Metals (M = Fe, Co, Ni, V) for Oxygen Reduction Reaction , 2012 .