0000000000515032

AUTHOR

L. González Macdowell

showing 2 related works from this author

Interface and Surface Properties of Short Polymers in Solution:  Monte Carlo Simulations and Self-Consistent Field Theory

2000

We investigate the structure and thermodynamics of inhomogeneous polymer solutions in the framework of a coarse-grained off-lattice model. Properties of the liquidvapor interface and the packing of...

Quantitative Biology::BiomoleculesMaterials sciencePolymers and PlasticsQuantum Monte CarloOrganic ChemistryMonte Carlo methodMonte Carlo method for photon transportCondensed Matter::Soft Condensed MatterInorganic ChemistryMaterials ChemistryDynamic Monte Carlo methodMonte Carlo method in statistical physicsKinetic Monte CarloDirect simulation Monte CarloStatistical physicsMonte Carlo molecular modelingMacromolecules
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How Do Droplets Depend on the System Size? Droplet Condensation and Nucleation in Small Simulation Cells

2003

Using large scale grandcanonical Monte Carlo simulations in junction with a multicanonical reweighting scheme we investigate the liquid-vapor transition of a Lennard—Jones fluid. Particular attention is focused on the free energy of droplets and the transition between different system configurations as the system tunnels between the vapor and the liquid state as a function of system size. The results highlight the finite size dependence of droplet properties in the canonical ensemble and free energy barriers along the path from the vapor to the liquid in the grandcanonical ensemble.

Condensed Matter::Soft Condensed MatterPhysics::Fluid DynamicsCanonical ensembleLiquid stateMaterials scienceScale (ratio)Monte Carlo methodCondensationNucleationMechanicsSize dependence
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