Interatomic potentials: Achievements and challenges
Interatomic potentials approximate the potential energy of atoms as a function of their
coordinates. Their main application is the effective simulation of many-atom systems. Here …
coordinates. Their main application is the effective simulation of many-atom systems. Here …
[HTML][HTML] Review of force fields and intermolecular potentials used in atomistic computational materials research
Molecular simulation is a powerful computational tool for a broad range of applications
including the examination of materials properties and accelerating drug discovery. At the …
including the examination of materials properties and accelerating drug discovery. At the …
Machine learning a general-purpose interatomic potential for silicon
The success of first-principles electronic-structure calculation for predictive modeling in
chemistry, solid-state physics, and materials science is constrained by the limitations on …
chemistry, solid-state physics, and materials science is constrained by the limitations on …
Phase-field model of mode III dynamic fracture
We introduce a phenomenological continuum model for the mode III dynamic fracture that is
based on the phase-field methodology used extensively to model interfacial pattern …
based on the phase-field methodology used extensively to model interfacial pattern …
Effective toughness of heterogeneous media
We propose a versatile approach to computing the effective toughness of heterogeneous
media. This approach focusses on the material property independent of the details of the …
media. This approach focusses on the material property independent of the details of the …
Instability in dynamic fracture
J Fineberg, M Marder - Physics Reports, 1999 - Elsevier
The fracture of brittle amorphous materials is an especially challenging problem, because
the way a large object shatters is intimately tied to details of cohesion at microscopic scales …
the way a large object shatters is intimately tied to details of cohesion at microscopic scales …
Continuum field description of crack propagation
IS Aranson, VA Kalatsky, VM Vinokur - Physical review letters, 2000 - APS
We develop continuum field model for crack propagation in brittle amorphous solids. The
model is represented by equations for elastic displacements combined with the order …
model is represented by equations for elastic displacements combined with the order …
Dynamic fracture in single crystal silicon
We have measured the velocity of a running crack in brittle single crystal silicon as a function
of energy flow to the crack tip. The experiments are designed to permit direct comparison …
of energy flow to the crack tip. The experiments are designed to permit direct comparison …
Directional anisotropy in the cleavage fracture of silicon
R Pérez, P Gumbsch - Physical review letters, 2000 - APS
Total-energy pseudopotential calculations are used to study the cleavage anisotropy in
silicon. It is shown that cracks propagate easily on {111} and {110} planes provided crack …
silicon. It is shown that cracks propagate easily on {111} and {110} planes provided crack …
Relationships between vitamin A, iron status and helminthiasis in Bangladeshi school children
V Persson, F Ahmed, M Gebre-Medhin… - Public health …, 2000 - cambridge.org
ObjectiveTo explore the relationships between biochemical indicators of vitamin A and iron
status and the intestinal helminths Ascaris lumbricoides and hookworm in primary school …
status and the intestinal helminths Ascaris lumbricoides and hookworm in primary school …