Project ID: plumID:19.051
Name: Solid liquid interfacial free energy out of equilibrium
Archive: https://github.com/gtribello/plumed-inputs/raw/master/BQ1/inputs.zip
Category: materials
Keywords: metadynamics, nucleation, surface excess free energy
Contributor: Gareth Tribello
Submitted on: 04 Jun 2019
Publication: B. Cheng, G. A. Tribello, M. Ceriotti, Solid-liquid interfacial free energy out of equilibrium. Physical Review B. 92 (2015)
PLUMED input files
| File | Compatible with |
|---|---|
| plumed.dat |   |
Last tested: 16 Jan 2025, 20:39:44
Project description and instructions
This is an example input file for the metadynamics calculations that were performed in this paper in order to calculate the surface excess free energy. As detailed in the paper and its SI these simulations were performed with LAMMPS
Submission history
[v1] 04 Jun 2019: original submission
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