ReaxFF Reactive Force-Field Modeling of the Triple-Phase Boundary in a Solid Oxide Fuel Cell-Reference-Cited by-同舟云学术

ReaxFF Reactive Force-Field Modeling of the Triple-Phase Boundary in a Solid Oxide Fuel Cell

Published:2014-11-06 Issue:22 Volume:5 Page:4039-4043
ISSN:1948-7185
Container-title:The Journal of Physical Chemistry Letters
language:en
Short-container-title:J. Phys. Chem. Lett.

Author:

Merinov Boris V.¹,Mueller Jonathan E.¹,van Duin Adri C. T.²,An Qi¹,Goddard William A.¹

Affiliation:

1. Materials and Process Simulation Center, California Institute of Technology, 1200 East California Boulevard, m/c 139-74, Pasadena, California 91125, United States

2. Department of Mechanical and Nuclear Engineering, Pennsylvania State University, 136 Research Building East, University Park, Pennsylvania 16802, United States

Funder

Office of Naval Research

Publisher

American Chemical Society (ACS)

Subject

General Materials Science,Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jz501891y

Reference26 articles.

1. Modeling Elementary Heterogeneous Chemistry and Electrochemistry in Solid-Oxide Fuel Cells

2. Ammonia-fed solid oxide fuel cells for power generation-A review

3. Catalytic aspects of the steam reforming of hydrocarbons in internal reforming fuel cells