Current Research Electrocatalysts

LMO Surfaces

Using first principles approaches, we examine LMO surfaces as an effective electrocatalyst for water splitting applications.

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Alloy Nanoparticles in Water

Using advanced Neural Network techniques, we examine large gold nanoparticles and their effects on electrocatalytic reactions for CO2 capture and conversion

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CO2 Reduction WC


Using first principles approaches we examine the reaction pathway of CO2 on Transition Metal Carbides

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High Temperature BaTiO3 Properties

First principles methods are used to examine the high temperature phase transitions between cubic and tetragonal phase BaTiO3

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