
Статья
2020
Aluminum Doped Silicon Nanocage as High Efficiency Catalysts to Oxygen Reduction Reaction





Российский электрохимический журнал
https://doi.org/10.1134/S1023193520060142
Abstract / Full Text
In the acidic condition the oxygen reduction reaction (ORR) through the aluminum doped silicon nanocage (Al–Si78) is studied. The ORR reactions are examined by theoretical methods and optimum pathways for ORR on Al–Si78 are examined. Results indicated that the Al–Si78 catalyzed the ORR through the LH and ER paths. Calculated parameters displayed that ER and LH paths are optimum pathways for ORR on surface of Al–Si78. Results demonstrated that the Al–Si78 can be considered as high potential catalyst to ORR.
Author information
- School of Engineering, Honghe University, 661199, Mengzi, China Li Yan, Yingfang Li & Bo Yang
- School of Information Science and Technology, Yunnan Normal University, 650500, Kunming, ChinaWei Gao
- Medical Biology Research Center, Kermanshah University of Medical Sciences, 67149-67346, Kermanshah, IranMeysam Najafi
References
- Oezaslan, M., Hasche, F., and Strasser, P., Pt-based core–shell catalyst architectures for oxygen fuel cell electrodes, J. Phys. Chem. Lett., 2013, vol. 4, p. 3273.
- Ge, X., Chen, L., Kang, J., Fujita, T., Hirata, A., Zhang, W., Jiang, J., and Chen, M., A core–shell nanoporous Pt–Cu catalyst with tunable composition and high catalytic activity, Adv. Funct. Mater., 2013, vol. 23, p. 4156.
- Thompsett, D., Catalysts for the proton exchange membrane fuel cell, in Handbook of Fuel Cells. Fundamentals, Technology and Applications, Adv. Funct. Mater., 2014, vol. 22, p. 1245.
- Xu, C., Liu, Yu., Wang, J., Geng, H., and Qiu, H., Fabrication of nanoporous Cu–Pt(Pd) core/shell structure by galvanic replacement and its application in electrocatalysis, ACS Appl. Mater. Interfaces, 2011, vol. 3, p. 4626.
- Guterman, V.E., Belenov, S.V., Pakharev, A.Yu., Min, M., Tabachkova, N.Yu., Mikheykina, E.B., Vysochina, L.L., and Lastovina, T.A., Pt–M/C (M = Cu, Ag) electrocatalysts with an inhomogeneous distribution of metals in the nanoparticles, Int. J. Hydrogen Energy, 2016, vol. 41, p. 1609.
- Zhu, H., Li, X., and Wang, F., Synthesis and characterization of CuPt/C core–shell structured catalysts for proton exchange membrane fuel cell, Int. J. Hydrogen Energy, 2011, vol. 36, p. 9151.
- Parsons, R., General equations for the kinetics of electrode processes, Trans. Faraday Soc., 1951, vol. 47, p. 1332.
- Exner, K.S. and Over, H., Kinetics of electrocatalytic reactions from first-principles: a critical comparison with the ab initio thermodynamics approach, Acc. Chem. Res., 2017, vol. 50, p. 1240.
- Exner, K.S., Sohrabnejad-Eskan, I., and Over, H., A universal approach to determine the free energy diagram of an electrocatalytic reaction, ACS Catal., 2018, vol. 8, p. 1864.
- Koper, M.T.M., Analysis of electrocatalytic reaction schemes: distinct ion between rate-determining and potential-determ ining steps, J. Solid State Electrochem., 2013, vol. 17, p. 339.
- Exner, K.S., Is thermodynamics a good descriptor for the activity? Re-investigation of Sabatiers principle by the free energy diagram in electrocatalysis, ACS Catal., 2019, vol. 9, p. 5320.
- Exner, K.S. and Over, H., Beyond the rate-determining step in the oxygen evolution reaction over a single-crystalline IrO2 (110) model electrode: kinetic scaling relations, ACS Catal., 2019, vol. 9, p. 6755.
- Rossmeisl, J., Qu, Z.W., Zhu, H., Kroes, G.J., and Nørskov, J.K., Electrolysis of water on oxide surfaces, J. Electroanal. Chem., 2007, vol. 607, p. 83.
- Nørskov, J.K. and Rossmeisl, J., Origin of the over-potential for oxygen reduction at a fuel-cell cathode, J. Phys. Chem. B, 2004, vol. 108, p. 17886.
- Bezerra, C.W.B., Zhang, L., Liu, H., Lee, K., Marqués, A.L.B., Marques, E.P., Wang, H., and Zhang, J., A review of heat-treatment effects on activity and stability of PEM fuel cell catalysts for oxygen reduction reaction, J. Power Sources, 2007, vol. 173, p. 891.
- Carbonio, E.A., Colmati, F., Ciapina, E.G., Pereira, M.E., and Gonzalez, E.R., Pt–Cu/C and Pd modified Pt–Cu/C electrocatalysts for the oxygen reduction reaction in direct methanol fuel cells, J. Braz. Chem. Soc., 2010, vol. 21, p. 590.
- Chandran, R. and Dharmalingam, S., Facile synthesis and characterization of PtCu core–shell and alloy nanoparticles, Nanosci. Nanotechnol., 2014, vol. 14, p. 1.
- Marcu, T.G., Srivastava, R., and Strasser, P., Preparation, characterization and degradation mechanisms of PtCu alloy nanoparticles for automotive fuel cells, J. Power Sources, 2012, vol. 208, p. 288.
- Ge, X., Chen, L., Kang, J., Fujita, T., Hirata, A., Zhang, W., Jiang, J., and Chen, M., A core–shell nanoporous Pt–Cu catalyst with tunable composition and high catalytic activity, Adv. Funct. Mater., 2013, vol. 23, p. 4156.
- Liu, J., One-pot synthesis of unprotected PtPd nanoclusters with enhanced catalytic activity, durability, and methanol-tolerance for oxygen reduction reaction, Appl. Surf. Sci., 2019, vol. 473, p. 318.
- Tritsaris, G.A., Trends in oxygen reduction and methanol activation on transition metal chalcogenides, Electrochim. Acta, 2011, vol. 56, p. 9783.
- Si, C., Highly electrocatalytic activity and excellent methanol tolerance of hexagonal spinel-type Mn2AlO4 nanosheets towards oxygen reduction reaction: experiment and density functional theory calculation, Nano Energy, 2016, vol. 23, p. 105.
- Exner, K.S., Anton, J., Jacob, T., and Over, H., Full kinetics from first-principles of the chlorine evolution reaction over RuO2 (110) model electrode, Angew. Chem. Int. Ed., 2016, vol. 55, p. 7501.
- Gauthier, J.A., Dickens, C.F., Chen, L.D., Doyle, A.D., and Nørskov, J.K., Solvation effects for oxygen evolution reaction catalysis on IrO2(110), J. Phys. Chem. C, 2017, vol. 121, p. 11455.
- Ping, Y., Nielsen, R.J., and Goddard, W.A., The reaction mechanism with free energy barriers at constant potentials for the oxygen evolution reaction at the IrO2 (110) surface, J. Am. Chem. Soc., 2017, vol. 139, p. 149.
- Kuo, D.Y., Kawasaki, J.K., Nelson, J.N., Kloppenburg, J., Hautier, G., Shen, K.M., Schlom, D.G., and Suntivich, J., Influence of surface adsorption on the oxygen evolution reaction on IrO2 (110), J. Am. Chem. Soc., 2017, vol. 139, p. 3473.
- Briquet, L.G.V., Sarwar, M., Mugo, J., Jones, G., and Calle-Vallejo, F., A new type of scaling relations to assess the accuracy of computational predictions of catalytic activities applied to the oxygen evolution reaction, ChemCatChem., 2017, vol. 9, p. 1261.