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Reply to "Comment on 'Phase diagram of MgO from density-functional theory and molecular-dynamics simulations'"

Alejandro Strachan, Tahir Çağın, William A. Goddard III

2001Phys. Rev. B, 63(9), Art. No. 09610215cited

Abstract

In answer to a Comment by Belonoshko [Phys. Rev. B 63, 096101 (2001)], we show that the B1-liquid melting curve of MgO obtained using two-phase simulations is in good agreement with the published one obtained using the Clausius-Clapeyron equation in conjunction with separate single phase calculations of liquid and solid.

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Strachan, A., Çağın, T., & III, W. A. G. (2001). Reply to "Comment on 'Phase diagram of MgO from density-functional theory and molecular-dynamics simulations'". *Phys. Rev. B*, *63*(9), Art. No. 096102. https://doi.org/10.1103/PhysRevB.63.096102