Extraction of effective solid-liquid interfacial free energies for full 3D solid crystallites from equilibrium MD simulations

Seeding approach to crystal nucleation

(2016) Jorge R. Espinosa et al.   JOURNAL OF CHEMICAL PHYSICS

Crystallization in supercooled liquid Cu: Homogeneous nucleation and growth

(2015) J. C. E et al.   JOURNAL OF CHEMICAL PHYSICS

Solid-liquid interfacial free energy out of equilibrium

(2015) Bingqing Cheng et al.   PHYSICAL REVIEW B

Crystal-liquid interfacial free energy of hard spheres via a thermodynamic integration scheme

(2015) Ronald Benjamin et al.   PHYSICAL REVIEW E

Nanoparticle shapes by using Wulff constructions and first-principles calculations

(2015) Georgios D Barmparis et al.   Beilstein Journal of Nanotechnology

Crystal-liquid interfacial free energy via thermodynamic integration

(2014) Ronald Benjamin et al.   JOURNAL OF CHEMICAL PHYSICS

Calculation of solid–liquid interfacial free energy of Cu by two different methods

(2013) Huaguang Zhou et al.   JOURNAL OF CRYSTAL GROWTH

Temperature dependence of the crystal–melt interfacial energy of metals

(2012) Zengyun Jian et al.   ACTA MATERIALIA

Structure identification methods for atomistic simulations of crystalline materials

(2012) Alexander Stukowski   MODELLING AND SIMULATION IN MATERIALS SCIENCE AND ENGINEERING

Solid-liquid interface free energy through metadynamics simulations

(2010) Stefano Angioletti-Uberti et al.   PHYSICAL REVIEW B

Effect of nonhydrostatic stresses on solid-fluid equilibrium. I. Bulk thermodynamics

(2010) T. Frolov et al.   PHYSICAL REVIEW B

Visualization and analysis of atomistic simulation data with OVITO–the Open Visualization Tool

(2009) Alexander Stukowski   MODELLING AND SIMULATION IN MATERIALS SCIENCE AND ENGINEERING

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

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

Solidification microstructures and solid-state parallels: Recent developments, future directions

(2008) M. Asta et al.   ACTA MATERIALIA