Reply to “Comment on ‘Phase diagram of MgO from density-functional theory and molecular- dynamics simulations’”

  • Alejandro Strachan
  • , Tahir Çağın
  • , William A. Goddard

Research output: Contribution to journalLetterpeer-review

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.

Original languageEnglish
JournalPhysical Review B - Condensed Matter and Materials Physics
Volume63
Issue number9
DOIs
Publication statusPublished - 5 Feb 2001
Externally publishedYes

Fingerprint

Dive into the research topics of 'Reply to “Comment on ‘Phase diagram of MgO from density-functional theory and molecular- dynamics simulations’”'. Together they form a unique fingerprint.

Cite this