A covalent molecular design enabling efficient CO2 reduction in strong acids

UFF, a full periodic table force field for molecular mechanics and molecular dynamics simulations

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The path towards sustainable energy

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Charge equilibration for molecular dynamics simulations

Anthony K. Rappé, William A. Goddard · The Journal of Physical Chemistry · 1991 · 3.4K citations

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Rational catalyst and electrolyte design for CO2 electroreduction towards multicarbon products

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Natural Sciences, Chemical Engineering, Chemistry +16

CO ₂ electrolysis to multicarbon products in strong acid

Jianan Erick Huang, Fengwang Li, Adnan Ozden et al. · Science · 2021 · 1.3K citations · Full text

Engineering, Chemical Engineering, Chemistry +17