Lennard-Jones systems near solid walls: Computing interfacial free energies from molecular simulation methods

Erratum: “Wall-liquid and wall-crystal interfacial free energies via thermodynamic integration: A molecular dynamics simulation study” [J. Chem. Phys. 137, 044707 (2012)]

(2013) Ronald Benjamin et al.   JOURNAL OF CHEMICAL PHYSICS

METHODS TO COMPUTE PRESSURE AND WALL TENSION IN FLUIDS CONTAINING HARD PARTICLES

(2012) DEBABRATA DEB et al.   INTERNATIONAL JOURNAL OF MODERN PHYSICS C

Phase diagram of the modified Lennard-Jones system

(2012) Yuta Asano et al.   JOURNAL OF CHEMICAL PHYSICS

Comparison of free-energy estimators and their dependence on dissipated work

(2012) Seongjin Kim et al.   PHYSICAL REVIEW E

Hard sphere fluids at a soft repulsive wall: A comparative study using Monte Carlo and density functional methods

(2011) Debabrata Deb et al.   JOURNAL OF CHEMICAL PHYSICS

Hard spheres revisited: Accurate calculation of the solid–liquid interfacial free energy

(2010) Ruslan L. Davidchack   JOURNAL OF CHEMICAL PHYSICS

Solid-liquid surface free energy of Lennard-Jones liquid on smooth and rough surfaces computed by molecular dynamics using the phantom-wall method

(2010) Frédéric Leroy et al.   JOURNAL OF CHEMICAL PHYSICS

Calculation of the interfacial free energy of a fluid at a static wall by Gibbs–Cahn integration

(2010) Brian B. Laird et al.   JOURNAL OF CHEMICAL PHYSICS

Solid-liquid interface free energy in binary systems: Theory and atomistic calculations for the (110) Cu–Ag interface

(2009) T. Frolov et al.   JOURNAL OF CHEMICAL PHYSICS

Determination of the solid-liquid interfacial free energy along a coexistence line by Gibbs–Cahn integration

(2009) Brian B. Laird et al.   JOURNAL OF CHEMICAL PHYSICS

Precise Determination of the Melting Point of a Modified Lennard-Jones System

(2009) Yuta Asano et al.   JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN

Temperature dependence of the surface free energy and surface stress: An atomistic calculation for Cu(110)

(2009) T. Frolov et al.   PHYSICAL REVIEW B