Dislocations in naturally deformed olivine: Example of a mylonitic peridotite

S Demouchy, A Mussi, T Weidner, E Gardés… - Physics of the Earth and …, 2024 - Elsevier
We have investigated the microstructure of naturally deformed olivine (chemically
equilibrated at 1000° C) by conventional transmission electron microscopy and electron …

[HTML][HTML] Structures and energies of twist grain boundaries in Mg2SiO4 forsterite

J Furstoss, P Hirel, P Carrez, K Gouriet… - Computational Materials …, 2024 - Elsevier
In this work, we investigate twist grain boundary (GB) energies and structures in Mg 2 SiO 4
forsterite using atomistic simulations. We first present a new bond orientational order …

Molecular Dynamics Simulation of Forsterite and Magnesite Mechanical Properties: Does Mineral Carbonation Reduce Comminution Energy?

A Talapatra, B Nojabaei - Sustainability, 2023 - mdpi.com
This work compares the mechanical properties of two geomaterials: forsterite and
magnesite. Various physical conditions are considered to investigate the evolution of stress …

A critical assessment of interatomic potentials for modelling lattice defects in forsterite MgSiO from 0 to 12 GPa

P Hirel, J Furstoss, P Carrez - Physics and Chemistry of Minerals, 2021 - Springer
Five different interatomic potentials designed for modelling forsterite Mg 2 SiO 4 are
compared to ab initio and experimental data. The set of tested properties include lattice …

On the glide of [100] dislocation and the origin of 'pencil glide' in Mg2SiO4 olivine

S Mahendran, P Carrez, P Cordier - Philosophical Magazine, 2019 - Taylor & Francis
Olivine with chemical composition (Mg, Fe) 2SiO4 is a silicate which is supposed to strongly
constrain the flow of the Earth's upper mantle under thermal convection. Its mechanical …

Activation of [100](001) slip system by water incorporation in olivine and the cause of seismic anisotropy decrease with depth in the asthenosphere

L Wang, N Miyajima, T Kawazoe, T Katsura - American Mineralogist, 2019 - degruyter.com
A transition from A-type to E-type fabrics in olivine may be the cause of a decrease in
seismic anisotropy with depth in the upper mantle. To better understand upper mantle …

Effect of deformation on helium storage and diffusion in polycrystalline forsterite

R Delon, S Demouchy, Y Marrocchi, MA Bouhifd… - … et Cosmochimica Acta, 2020 - Elsevier
Although recent studies have investigated He behavior in undeformed mantle minerals, the
effect of defects generated by plastic deformation on He storage and transport remains …

The core structure of screw dislocations with [001] Burgers vector in MgSiO olivine

S Mahendran, P Carrez… - Comptes …, 2021 - comptes-rendus.academie-sciences …
In this study, we report atomistic calculations of the core structure of screw dislocations with
[001] Burgers vector in Mg2SiO4 olivine. Computations based on the THB1 empirical …

Molecular Dynamics Simulation of Forsterite and Magnesite Mechanical Properties: Effect of Carbonation on Comminution Energy

A Talapatra - 2024 - vtechworks.lib.vt.edu
Mineral carbonation contributes to CO2 reduction, and it may also reduce the cost of mineral
processing by improving the mechanical properties of rock/ore. Here, we study and compare …

Interactions between bare and protonated Mg vacancies and dislocation cores in MgO

R Skelton, AM Walker - Physics and Chemistry of Minerals, 2019 - Springer
Water can be incorporated into the lattice of mantle minerals in the form of protons charge-
balanced by the creation of cation vacancies. These protonated vacancies, when they …