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초록· 키워드
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Design of novel materials in renewable energy systems plays a key role in powering transportation vehicles and portable electronics. This review introduces the research work of first principles-based computational design for the materials over the last decade to accomplish the goal with less financial and temporal cost beyond the conventional approach, especially, focusing on electrocatalyst toward a proton exchange membrane fuel cell (PEMFC). It is proposed that the new method combined with experimental validation, can provide fundamental descriptors and mechanical understanding for optimal efficiency control of a whole system. Advancing these methods can even realize a computational platform of the materials genome, which can substantially reduce the time period from discovery to commercialization into markets of new materials.
목차
Abstract
1. Introduction
2. Computational Details and Model System
3. Results and Discussion
4. Conclusion
References
참고문헌 (33)
참고문헌 신청
John Conti, International Energy Outlook 2016. DOE, Ed. Washington, DC, (2016) 1-18.
Gregorio Marban, Teresa Valdes-Solis, Towards the hydrogen economy, Int. J. Hydrogen Energy 32 (2007) 1625-1637.
S Dasappa, PJ Paul, HS Mukunda, NKS Rajan, G Sridhar, HV Sridhar, Biomass gasification technology?a route to meet energy needs. Curr. Sci. 87 (2004) 908-916.
A Boudghene Stambouli, E Traversa, Fuel cells, an alternative to standard sources of energy. Renewable Sustainable Energy Rev. 6 (2002) 295- 304.
C Retna Raj, Arpan Samanta, Seung Hyo Noh, Siniya Mondal, Takeyoshi Okajima, Takeo Ohsaka, Emerging new generation electrocatalysts for the oxygen reduction reaction. J. Mater. Chem. A 4 (2016) 11156-11178.
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UCI(KEPA) : I410-ECN-0101-2017-581-002303769