Initial oxidation of nano-aluminum particles by H2O/H2O2: Molecular dynamics simulation
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DOI: 10.1016/j.ijhydene.2020.09.164
Abstract: Abstract Molecular dynamics simulations on the reactions of nano-aluminum, water with different proportions of hydrogen peroxide were performed by ReaxFF. The reaction rate of the system increases by 27% as the molar ratio of H2O2… read more here.
Keywords: molar ratio; molecular dynamics; nano aluminum; h2o h2o2 ... See more keywords
On the Reduction of O2 on Cathode Surfaces of Co–Corrin and Co–Porphyrin: A Computational and Experimental Study on Their Relative Efficiencies in H2O/H2O2 Formation
Sign Up to like & getrecommendations! Published in 2020 at "Journal of Physical Chemistry C"
DOI: 10.1021/acs.jpcc.0c00481
Abstract: The mechanisms for O2 reduction and H2O/H2O2 formation on Co–corrin and Co–porphyrin cathode surfaces of the proton exchange membrane fuel cell (PEMFC) systems have been studied by hybrid Hartree–F... read more here.
Keywords: corrin porphyrin; reduction; cathode surfaces; h2o h2o2 ... See more keywords