DFT simulations predict low exfoliation energies (0.24 to 0.28 J/m2) and moderate tensile strengths (5.6 to 10.2 GPa) for Nb3X8 (X=Cl, Br, I) monolayers.
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A first-principles study on the physical properties of two-dimensional Nb3Cl8, Nb3Br8 and Nb3I8
DFT simulations predict low exfoliation energies (0.24 to 0.28 J/m2) and moderate tensile strengths (5.6 to 10.2 GPa) for Nb3X8 (X=Cl, Br, I) monolayers.