Concepedia

Temperature-dependent surface free energy and the Wulff shape of iron and iron carbide nanoparticles: A molecular dynamics study

Mengjiao Xing, Amar-Deep Pathak, Suchismita Sanyal, Xiaodong Wen

Applied Surface Science · 2019 · 29 citations · 42 references

DOI

Concepts

References

42

Fast Parallel Algorithms for Short-Range Molecular Dynamics

Steven J. Plimpton · Journal of Computational Physics · 1995 · 44.6K citations

, , +10

Understanding Molecular Simulation

Daan Frenkel, Berend Smit, Jan Tobochnik et al. · Computers in Physics · 1997 · 5.5K citations

, , +1

The surface energy of metals

Levente Vitos, A. V. Ruban, H. L. Skriver et al. · Surface Science · 1998 · 2.7K citations

, , +12

Surface free energies of solid metals: Estimation from liquid surface tension measurements

W. R. Tyson, W. Miller · Surface Science · 1977 · 2K citations

, , +16

New Monte Carlo method to compute the free energy of arbitrary solids. Application to the fcc and hcp phases of hard spheres

Daan Frenkel, Anthony J. C. Ladd · The Journal of Chemical Physics · 1984 · 1.3K citations

, , +15