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Fosse, J.K. - International Research Institute of Stavanger

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To analyze the accuracy of the DFT calculations a detailed convergence study is performed for several adsorbates on stepped hexagonal close-packed and face-centred cubic Ru slabs. Munter, TR, Bligaard, T, Christensen, CH and Nørskov, JK PHYSICAL CHEMISTRY CHEMICAL PHYSICS Volume: 10 Issue: 34 Pages: 

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