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Computational Modeling of Tensile Stress Effects on the Structure and Stability of Prototypical Covalent and Layered Materials

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Figure

Table 1. 1D-SEOS parameters from the fittings to our computed stress-strain data. Units of σsp are GPa.
Table 2. Zero pressure lattice and elastic constants of 3C- and 2H-SiC polytypes, graphite and 2H-MoSAll2
Table 3. Energy and Young modulus parameters from the integrated stress-strain SEOS fittings

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