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Surface terminations on Mo2CTx MXene catalysts dictate the selectivity of C1 products during CO2 reduction, with CH4 becoming the dominant product over CO at higher applied potentials, a dynamic accurately predicted by a novel integrated CHE/pseudo-MM approach. Novelty: ClaimNovelty.METHODOLOGICAL. Consensus alignment: ConsensusAlignment.NEUTRAL.

A theoretical and experimental study on CO 2 reduction selectivity of Mo 2 CT x MXene catalysts: Influence of surface termination

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