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The melting lines of model silicon calculated from coexisting solid–liquid phases
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11.We also performed an MD simulation for the coexisting SW/(100)/liquid system without using the new procedure. In this particular test, the stress anisotropy amounts to 30%. The calculated melting temperature at zero pressure is about 25 K below 1678 K (see Table I).
12.Based on the SW (100) data (see Table I), we calculated According to the Clausius–Clapeyron equation, where L is the latent heat and is the volume change at the melting. Using data of L, and at (see Table V of Ref. 8), we obtained which is in good agreement with the value within the error bar.
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