NERC High Performance Computing (ARCHER-JASMIN)
Lead Research Organisation:
Natural Environment Research Council
Department Name: UNLISTED
Abstract
Abstracts are not currently available in GtR for all funded research. This is normally because the abstract was not required at the time of proposal submission, but may be because it included sensitive information such as personal details.
People |
ORCID iD |
John Brodholt (Principal Investigator) |
Publications

Zhang Z
(2013)
Elastic properties of MgSiO3-perovskite under lower mantle conditions and the composition of the deep Earth
in Earth and Planetary Science Letters

Zhang Z
(2018)
Stability and Reactions of CaCO 3 Polymorphs in the Earth's Deep Mantle
in Journal of Geophysical Research: Solid Earth

Wang W
(2021)
Elasticity of hydrous ringwoodite at mantle conditions: Implication for water distribution in the lowermost mantle transition zone
in Earth and Planetary Science Letters

Wang W
(2021)
Sulfur isotopic signature of Earth established by planetesimal volatile evaporation
in Nature Geoscience

Wang W
(2021)
Strong shear softening induced by superionic hydrogen in Earth's inner core
in Earth and Planetary Science Letters

Wang K
(2015)
Helium diffusion in olivine based on first principles calculations
in Geochimica et Cosmochimica Acta

Wang K
(2020)
Diffusion of noble gases in subduction zone hydrous minerals
in Geochimica et Cosmochimica Acta

Vocadlo L
(2008)
The stability of bcc-Fe at high pressures and temperatures with respect to tetragonal strain
in Physics of the Earth and Planetary Interiors

Van Driel J
(2020)
The discontinuous effect of pressure on twin boundary strength in MgO
in Physics and Chemistry of Minerals

Trønnes R
(2020)
High-pressure silica phase transitions: Implications for deep mantle dynamics and silica crystallization in the protocore
in American Mineralogist

Thomson A
(2021)
Incorporation of tetrahedral ferric iron into hydrous ringwoodite
in American Mineralogist

Thomson A
(2019)
Seismic velocities of CaSiO3 perovskite can explain LLSVPs in Earth's lower mantle
in Nature

Thomas C
(2011)
Anisotropy as cause for polarity reversals of D? reflections
in Earth and Planetary Science Letters

Tackley P
(2014)
Habitable Planets: Interior Dynamics and Long-Term Evolution
in Proceedings of the International Astronomical Union

Tackley P
(2013)
Mantle dynamics in super-Earths: Post-perovskite rheology and self-regulation of viscosity
in Icarus

Sun T
(2018)
Melting properties from ab initio free energy calculations: Iron at the Earth's inner-core boundary
in Physical Review B

Stackhouse S
(2010)
Thermal conductivity of periclase (MgO) from first principles.
in Physical review letters

Stackhouse S
(2008)
Elastic properties of the post-perovskite phase of Fe2O3 and implications for ultra-low velocity zones
in Physics of the Earth and Planetary Interiors

Sola E
(2009)
Equation of state of hexagonal closed packed iron under Earth's core conditions from quantum Monte Carlo calculations
in Physical Review B

Richards M
(2013)
Petrological interpretation of deep crustal intrusive bodies beneath oceanic hotspot provinces
in Geochemistry, Geophysics, Geosystems

Ono S
(2008)
High-pressure phase transformations of FeS: Novel phases at conditions of planetary cores
in Earth and Planetary Science Letters

Ono S
(2011)
Elastic, thermal and structural properties of platinum
in Journal of Physics and Chemistry of Solids

Ono S
(2008)
Structural phase transitions in IrO 2 at high pressures
in Journal of Physics: Condensed Matter

Ono S
(2008)
First-principles simulation of high-pressure polymorphs in MgAl2O4
in Physics and Chemistry of Minerals

Ono S
(2018)
Phase transitions of BaCO 3 at high pressures
in Mineralogical Magazine

Ono S
(2008)
Ab initio molecular dynamics simulations for thermal equation of state of B2-type NaCl
in Journal of Applied Physics

Muir J
(2021)
The effect of water on the post-spinel transition and evidence for extreme water contents at the bottom of the transition zone
in Earth and Planetary Science Letters

Muir J
(2018)
Water distribution in the lower mantle: Implications for hydrolytic weakening
in Earth and Planetary Science Letters

Muir J
(2015)
Elastic properties of ferrous bearing MgSiO3 and their relevance to ULVZs
in Geophysical Journal International

Muir J
(2020)
Ferric iron in bridgmanite and implications for ULVZs
in Physics of the Earth and Planetary Interiors

Muir J
(2016)
Ferrous iron partitioning in the lower mantle
in Physics of the Earth and Planetary Interiors

Muir J
(2015)
Elastic properties of ferropericlase at lower mantle conditions and its relevance to ULVZs
in Earth and Planetary Science Letters

Martorell B
(2016)
The elastic properties of hcp-Fe 1-x Si x at Earth's inner-core conditions
in Earth and Planetary Science Letters

Martorell B
(2013)
Strong Premelting Effect in the Elastic Properties of hcp-Fe Under Inner-Core Conditions
in Science

Martorell B
(2015)
The elastic properties and stability of fcc-Fe and fcc-FeNi alloys at inner-core conditions
in Geophysical Journal International

Martorell B
(2013)
The effect of nickel on the properties of iron at the conditions of Earth's inner core: Ab initio calculations of seismic wave velocities of Fe-Ni alloys
in Earth and Planetary Science Letters

Lindsay-Scott A
(2011)
Thermoelastic properties and crystal structure of CaPtO 3 post-perovskite from 0 to 9 GPa and from 2 to 973 K
in Journal of Applied Crystallography

Lindsay-Scott A
(2010)
The isothermal equation of state of CaPtO3 post-perovskite to 40GPa
in Physics of the Earth and Planetary Interiors

Li Y
(2018)
The elastic properties of hcp-Fe alloys under the conditions of the Earth's inner core
in Earth and Planetary Science Letters

Li Y
(2019)
Carbon Partitioning Between the Earth's Inner and Outer Core
in Journal of Geophysical Research: Solid Earth

Li Y
(2020)
The Earth's core as a reservoir of water
in Nature Geoscience

Li Y
(2016)
Thermoelasticity of Fe 7 C 3 under inner core conditions
in Journal of Geophysical Research: Solid Earth

Li Y
(2018)
Mg partitioning between solid and liquid iron under the Earth's core conditions
in Physics of the Earth and Planetary Interiors

Li Y
(2021)
Equation of state for CO and CO2 fluids and their application on decarbonation reactions at high pressure and temperature
in Chemical Geology

Li L
(2011)
Prospecting for water in the transition zone: d ln(Vs)/d ln(Vp)
in Physics of the Earth and Planetary Interiors

Li L
(2011)
Ab initio molecular dynamic simulation on the elasticity of Mg3Al2Si3O12 pyrope
in Journal of Earth Science

Li L
(2009)
Ab initio molecular dynamics study of elasticity of akimotoite MgSiO3 at mantle conditions
in Physics of the Earth and Planetary Interiors

Li L
(2009)
Structure and elasticity of hydrous ringwoodite: A first principle investigation
in Physics of the Earth and Planetary Interiors

Karki B
(2013)
First principles viscosity and derived models for MgO-SiO 2 melt system at high temperature
in Geophysical Research Letters

Jakymiw C
(2017)
The phase diagrams of KCaF3 and NaMgF3 by ab initio simulations
in Physics and Chemistry of Minerals
Description | This provided HPC facilities for a large number of UK researchers in mineral physics. This produced work from the adsortion of Arsenic onto mineral surfaces, to estimates of the composition of the core. Recent highlights are new estimates for the composition of the Earth's inner and outer core. New insights into the role of water on the strengths of mantle minerals |
Exploitation Route | Not sure yet. |
Sectors | Chemicals Environment |