Onwudinanti, C. ., Pols, M. ., Brocks, G. ., Koelman, J. M. V. A., van Duin, A. T., Morgan, T. W., & Tao, S. . (2022). A ReaxFF molecular dynamics study of hydrogen diffusion in ruthenium - the role of grain boundaries. Journal of Physical Chemistry C, 126(13), 5950-5959. https://doi.org/10.1021/acs.jpcc.1c08776 (Original work published 2022)
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