Molecular dynamics simulation of edge crack propagation in single crystalline alpha quartz

Investigation of thermal properties of crystalline alpha quartz by employing different interatomic potentials: A molecular dynamic study

(2021) Fatemeh Molaei et al.   PHYSICS OF THE EARTH AND PLANETARY INTERIORS

Applying molecular dynamics simulation to take the fracture fingerprint of polycrystalline SiC nanosheets

(2021) Fatemeh Molaei et al.   COMPUTATIONAL MATERIALS SCIENCE

Atomic picture of crack propagation in Li 2 O‐2SiO 2 glass‐ceramics revealed by molecular dynamics simulations

(2020) Binghui Deng et al.   JOURNAL OF THE AMERICAN CERAMIC SOCIETY

Fracture Toughness and Surface Energy Density of Kerogen by Molecular Dynamics Simulations in Tensile Failure

(2020) Tianhao Wu et al.   Journal of Physical Chemistry C

Effects of temperature and grain size on the mechanical properties of polycrystalline quartz

(2020) Zhaoyang Ma et al.   COMPUTATIONAL MATERIALS SCIENCE

Combined molecular dynamics and phase-field modelling of crack propagation in defective graphene

(2019) Arne Claus Hansen-Dörr et al.   COMPUTATIONAL MATERIALS SCIENCE

A molecular dynamics study of the mechanical properties of h-BCN monolayer using a modified Tersoff interatomic potential

(2019) Ying-Yan Zhang et al.   PHYSICS LETTERS A

Irradiation‐induced brittle‐to‐ductile transition in α‐quartz

(2019) R. Ravinder et al.   JOURNAL OF THE AMERICAN CERAMIC SOCIETY

A novel chevron notched short rod bend method for measuring the mode I fracture toughness of rocks

(2018) Ming-Dong Wei et al.   ENGINEERING FRACTURE MECHANICS

A three dimensional adaptive multiscale method for crack growth in Silicon

(2018) P.R. Budarapu et al.   THEORETICAL AND APPLIED FRACTURE MECHANICS

Size effects on the fracture of microscale and nanoscale materials

(2018) Alessandro Taloni et al.   Nature Reviews Materials

A continuum-atomistic multi-scale technique for nonlinear behavior of nano-materials

(2018) A.R. Khoei et al.   INTERNATIONAL JOURNAL OF MECHANICAL SCIENCES

Molecular dynamics simulations on fracture toughness of Al2O3-SiO2 glass-ceramics

(2018) Binghui Deng et al.   SCRIPTA MATERIALIA

Effects of surface crack on the mechanical properties of Silica: A molecular dynamics simulation study

(2018) Sanjib C. Chowdhury et al.   ENGINEERING FRACTURE MECHANICS

Crack propagation in silica from reactive classical molecular dynamics simulations

(2017) Jessica M. Rimsza et al.   JOURNAL OF THE AMERICAN CERAMIC SOCIETY

Fracturing-hydraulic coupling in transversely isotropic rocks and a case study on CO2 sequestration

(2016) Baotang Shen et al.   INTERNATIONAL JOURNAL OF ROCK MECHANICS AND MINING SCIENCES

Concurrent multiscale modeling of three dimensional crack and dislocation propagation

(2015) Hossein Talebi et al.   ADVANCES IN ENGINEERING SOFTWARE

On force fields for molecular dynamics simulations of crystalline silica

(2015) Benjamin J. Cowen et al.   COMPUTATIONAL MATERIALS SCIENCE

Atomsk: A tool for manipulating and converting atomic data files

(2015) Pierre Hirel   COMPUTER PHYSICS COMMUNICATIONS

Crack propagation in graphene

(2015) P. R. Budarapu et al.   JOURNAL OF APPLIED PHYSICS

Atomic scale modeling of shock response of fused silica and α-quartz

(2015) J. Wang et al.   JOURNAL OF MATERIALS SCIENCE

Fracture toughness of calcium–silicate–hydrate from molecular dynamics simulations

(2015) M. Bauchy et al.   JOURNAL OF NON-CRYSTALLINE SOLIDS

Fracture characteristics of rocks under shear loading

(2014) John Kemeny et al.   KSCE Journal of Civil Engineering

Molecular dynamics simulations of edge cracks in copper and aluminum single crystals

(2014) C.B. Cui et al.   MATERIALS SCIENCE AND ENGINEERING A-STRUCTURAL MATERIALS PROPERTIES MICROSTRUCTURE AND PROCESSING

Efficient coarse graining in multiscale modeling of fracture

(2014) Pattabhi R. Budarapu et al.   THEORETICAL AND APPLIED FRACTURE MECHANICS

A computational library for multiscale modeling of material failure

(2013) Hossein Talebi et al.   COMPUTATIONAL MECHANICS

Visualization of the failure of quartz under quasi-static and dynamic compression

(2010) J. Kimberley et al.   JOURNAL OF GEOPHYSICAL RESEARCH

Visualization and analysis of atomistic simulation data with OVITO–the Open Visualization Tool

(2009) Alexander Stukowski   MODELLING AND SIMULATION IN MATERIALS SCIENCE AND ENGINEERING