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Published in 2021 at "Computational Condensed Matter"
DOI: 10.1016/j.cocom.2021.e00574
Abstract: Abstract Structural parameters, electronic band structure, optical spectra and thermal properties of hexagonal MoX2 (X = Te, Se and S) compound materials are investigated. The computations are performed using density-functional calculations within the generalized gradient approximation. All…
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Keywords:
structure fundamental;
mox2 compound;
structure;
electronic structure ... See more keywords
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Published in 2022 at "Frontiers in Chemistry"
DOI: 10.3389/fchem.2022.913874
Abstract: In this study, Cu-based multicomponent metallic compound materials M-Cu (M = Mn, Fe, Co, Ni, and Pt) were studied as electrocatalytic materials for water splitting. Different metal materials attached to the copper foam substrate can…
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Keywords:
multicomponent metallic;
based multicomponent;
water splitting;
metallic compound ... See more keywords