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For simplicity, the cation dissolution barriers under zero driving force were set to match the hopping barriers within the oxide. To compute accurate reference energy levels at the alloy-oxide boundary, we first used the recipe of ref. 71 to apply an energy shift of 1.36 eV to the O2 ...
oxide growth is dictated by the reprecipitation process and therefore linked to the dissolution rate. Dissolution kinetics. in turn, tracks with the thermodynamic driving force, which increases with voltage and acidity.
Nickel-catalyzed C–H bond functionalization reactions provide an impressive alternative to those with noble metal catalysts due to their unique reactivity and low cost. However, the regioselective C(sp2)–H borylation reaction of arenes accomplished by
catalytic mechanism, elucidated through meticulous ex-situ analyses and theoretical calculations (DFT). Moreover, the findings underscore the pivotal role of nickel species, encompassing Ni0, Ni2+, and Ni3+, along with carbon, in driving catalytic activity, offering promising avenues for the ...
In contrast, the anionic species becomes present in high percent within the pH range of 3–7, suggesting that the inner-sphere surface complexation is the main reason as a driving force for Ni2+ or Cd2+ uptake by iron oxide85. The effect of pH on the removal percentage of Cd2+ and Ni...
(tb) with increasing influent concentration as shown in Table7. As expected, the observed behavior may be credited to the overwhelming driving force provided by the higher inlet concentration difference in order for the adsorption process to overpower the resistance of mass transfer47. Apparently, ...