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Fletta eftir efnisorði "density functional theory calculations"

Fletta eftir efnisorði "density functional theory calculations"

Röðun: Raða: Niðurstöður:

  • Hussain, Javed; Jónsson, Hannes; Skulason, Egill (American Chemical Society (ACS), 2018-04-23)
    CO2 can be reduced electrochemically to form valuable chemicals such as hydrocarbons and alcohols using copper electrodes, whereas the other metal electrodes tested so far mainly form CO or formate, or only the side product, H2. Accurate modeling of ...