Title of article
QUANTITATIVE PREDICTION OF CRYSTAL-NUCLEATION RATES FOR SPHERICAL COLLOIDS: A Computational Approach
Author/Authors
Auer، Stefan نويسنده , , Frenkel، Dann نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 2004
Pages
29
From page
333
To page
361
Abstract
This review discusses the recent progress that has been made in the application of computer simulations to study crystal nucleation in colloidal systems.We discuss the concept and the numerical methods that allow for a quantitative prediction of crystal-nucleation rates. The computed nucleation rates are predicted from first principles and can be directly compared with experiments. These techniques have been applied to study crystal nucleation in hard-sphere colloids, polydisperse hardsphere colloids, weakly charged or slightly soft colloids, and hard-sphere colloids that are confined between two-plane hard walls.
Keywords
Monte Carlo , umbrella sampling , nucleation barrier , kinetic prefactor , classical nucleation theory , crystallization rates
Journal title
Annual Review of Physical Chemistry
Serial Year
2004
Journal title
Annual Review of Physical Chemistry
Record number
121426
Link To Document