Published November 17, 2010
| Version v1
Journal article
Crystallization kinetics of a 2D system using molecular dynamics simulation
- 1. Departamento de Fisica, Universidade Federal de Sao Carlos, 13.565-905, Sao Carlos, Sao Paulo (Brazil)
Description
We present a study about the crystallization behavior of a two-dimensional particle system via molecular dynamics simulation. The interaction potential used here is a modified version of the Lennard-Jones potential which has the square lattice as the stable crystal structure at zero-pressure. The growth rate and the thermodynamic melting point are determined using a system with a free surface in the x direction. We also performed simulations of a supercooled liquid system with periodic boundary conditions to estimate the nucleation rate, the critical nucleus size, and the time lag of nucleation. These properties are important tools for understanding the crystallization phenomenon in a variety of materials.
Availability note (English)
Available from http://dx.doi.org/10.1088/0953-8984/22/45/455106Additional details
Identifiers
- DOI
- 10.1088/0953-8984/22/45/455106;
- PII
- S0953-8984(10)66373-4;
Publishing Information
- Journal Title
- Journal of Physics. Condensed Matter
- Journal Volume
- 22
- Journal Issue
- 45
- Journal Page Range
- [6 p.]
- ISSN
- 0953-8984
- CODEN
- JCOMEL
INIS
- Country of Publication
- United Kingdom
- Country of Input or Organization
- International Atomic Energy Agency (IAEA)
- INIS RN
- 42030432
- Subject category
- S75: CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND SUPERFLUIDITY;
- Descriptors DEI
- BOUNDARY CONDITIONS; CRYSTALLIZATION; INTERACTIONS; KINETICS; LENNARD-JONES POTENTIAL; LIQUIDS; MELTING POINTS; MOLECULAR DYNAMICS METHOD; NUCLEATION; PERIODICITY; SIMULATION; SURFACES; TETRAGONAL LATTICES; TWO-DIMENSIONAL CALCULATIONS
- Descriptors DEC
- CALCULATION METHODS; CRYSTAL LATTICES; CRYSTAL STRUCTURE; FLUIDS; PHASE TRANSFORMATIONS; PHYSICAL PROPERTIES; POTENTIALS; THERMODYNAMIC PROPERTIES; TRANSITION TEMPERATURE; VARIATIONS