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Solubility of carbon in α-iron under volumetric strain and close to the Σ5(3 1 0)[0 0 1] grain boundary: Comparison of DFT and empirical potential methods

✍ Scribed by Elisaveta Hristova; Rebecca Janisch; Ralf Drautz; Alexander Hartmaier

No coin nor oath required. For personal study only.

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Solubility of carbon in α-iron under volumetric strain and close to the Σ5(3&#xa0;1&#xa0;0)[0&#xa0;0&#xa0;1] grain boundary: Comparison of DFT and empirical potential methods