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Feasibility of N2 Binding and Reduction to Ammonia on Fe-Deposited MoS2 2D Sheets: A DFT Study

Luis Miguel Azofra1, Chenghua Sun2, Luigi Cavallo1

  • 1KAUST Catalysis Center (KCC), King Abdullah University of Science and Technology (KAUST), Thuwal, 23955-6900, Saudi Arabia.

Chemistry (Weinheim an Der Bergstrasse, Germany)
|May 20, 2017
PubMed

Keywords:
MoS2N2 captureN2 conversionNH3 electro-synthesiscomputer-aided design

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