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Theoretical insight into effect of cation–anion pairs on CO<sub>2</sub> reduction on bismuth electrocatalysts
Published 2020“…<p dir="ltr">This study presents theoretical insight into the mechanism of the CO<sub>2</sub> reduction reaction (CO<sub>2</sub>RR) to formic acid (HCOOH) on Bi (0 1 2) surfaces in the presence of alkali metal cations (M<sup>+</sup>: Cs<sup>+</sup>, K<sup>+</sup>, and Li<sup>+</sup>) and/or halide anions (X<sup>−</sup>: Cl<sup>−</sup>, Br<sup>−</sup>, and I<sup>−</sup>) using density functional theory (DFT). …”
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Comprehensive thermoeconomic, exergoeconomic, and optimization analyses of direct oxy‐combustion supercritical CO<sub>2</sub> intercooled and reheated cycles under design and off‐d...
Published 2022“…<p dir="ltr">This study presents comprehensive energetic, exergetic, exergoeconomic, and economic (4E) performance analyses for four direct oxy‐combustion (DOC) supercritical carbon dioxide (sCO2) power cycles at design, off‐design, and part‐load conditions. …”
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