Stochastic Dynamics Of Crystal Defects
File(s)
Author(s)
Swinburne, Thomas
Type
Thesis or dissertation
Abstract
The state of a deformed crystal is highly heterogeneous, with plasticity localised into linear and point defects such as dislocations, vacancies and interstitial clusters. The motion of these defects dictate a crystal’s mechanical behaviour, but defect dynamics are complicated and correlated by external applied stresses, internal elastic interactions and the fundamentally stochastic influence of thermal vibrations.
This thesis is concerned with establishing a rigorous, modern theory of the stochastic and dissipative forces on crystal defects, which remain poorly understood despite their importance in any temperature dependent micro-structural process such as the ductile to brittle transition and irradiation damage.
From novel molecular dynamics simulations we parametrise an efficient, stochastic and discrete dislocation model that allows access to experimental time and length scales. Simulated trajectories of thermally activated dislocation motion are in excellent agreement with those measured experimentally.
Despite these successes in coarse graining, we find existing theories unable to explain stochastic defect dynamics. To resolve this, we define crystal defects through projection operators, without any recourse to elasticity. By rigorous dimensional reduction we derive explicit analytical forms for the stochastic forces acting on crystal defects, allowing new quantitative insight into the role of thermal fluctuations in crystal plasticity.
This thesis is concerned with establishing a rigorous, modern theory of the stochastic and dissipative forces on crystal defects, which remain poorly understood despite their importance in any temperature dependent micro-structural process such as the ductile to brittle transition and irradiation damage.
From novel molecular dynamics simulations we parametrise an efficient, stochastic and discrete dislocation model that allows access to experimental time and length scales. Simulated trajectories of thermally activated dislocation motion are in excellent agreement with those measured experimentally.
Despite these successes in coarse graining, we find existing theories unable to explain stochastic defect dynamics. To resolve this, we define crystal defects through projection operators, without any recourse to elasticity. By rigorous dimensional reduction we derive explicit analytical forms for the stochastic forces acting on crystal defects, allowing new quantitative insight into the role of thermal fluctuations in crystal plasticity.
Version
Open Access
Date Issued
2014-09
Date Awarded
2015-03
Advisor
Sutton, Adrian
Dudarev, Sergei
Sponsor
Engineering and Physical Sciences Research Council
European Commission
Grant Number
PHCM G01400
Publisher Department
Physics
Publisher Institution
Imperial College London
Qualification Level
Doctoral
Qualification Name
Doctor of Philosophy (PhD)