Abstract
We report Monte Carlo studies of solid-fluid coexistence for the soft-sphere potential: (r)=(r)n. Applying a recently developed integration method that proceeds along a coexistence line, we determined coexistence for essentially a continuum of softness s1n from s=0 (hard spheres) to ca. s=0.25. For s<0.16, we estimate that fcc is the stable crystal, and that bcc is stable for softer potentials; however, this result is not conclusive. We find substantial disagreement with early coexistence data for n=12, 9, 6, and 4, while confirming more recent studies for n=12 and 6.
| Original language | English |
|---|---|
| Pages (from-to) | 122-125 |
| Number of pages | 4 |
| Journal | Physical Review Letters |
| Volume | 74 |
| Issue number | 1 |
| DOIs | |
| State | Published - 1995 |
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