Project ID: plumID:19.052
Name: Gibbs free energy of homogeneous nucleation
Archive: https://github.com/gtribello/plumed-inputs/raw/master/BQ2/inputs.zip
Category: materials
Keywords: nucleation, surface excess free energy
Contributor: Gareth Tribello
Submitted on: 04 Jun 2019
Publication: B. Cheng, G. A. Tribello, M. Ceriotti, The Gibbs free energy of homogeneous nucleation: From atomistic nuclei to the planar limit. The Journal of Chemical Physics. 147 (2017)

PLUMED input files

File Compatible with
plumed.dat tested on v2.9 tested on master

Last tested: 27 Mar 2024, 17:07:32

Project description and instructions
This file is in the input file that was used for the metadynamics simulation that was used to extract the free energy as a function of the size of the number of atoms in the three-dimensional nucleus. The simulations in this work were performed using LAMMPS.

Submission history
[v1] 04 Jun 2019: original submission

Badge
Click on the image below and get the code to add the badge to your website!
plumeDnest:19.052