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
Ono S
(2008)
High-pressure phase transformations of FeS: Novel phases at conditions of planetary cores
in Earth and Planetary Science Letters
Ono S
(2008)
First-principles simulation of high-pressure polymorphs in MgAl2O4
in Physics and Chemistry of Minerals
Côté A
(2008)
Light elements in the core: Effects of impurities on the phase diagram of iron
in Geophysical Research 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
Ono S
(2008)
Structural phase transitions in IrO 2 at high pressures
in Journal of Physics: Condensed Matter
Côté A
(2008)
The effect of silicon impurities on the phase diagram of iron and possible implications for the Earth's core structure
in Journal of Physics and Chemistry of Solids
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
Ono S
(2008)
Ab initio molecular dynamics simulations for thermal equation of state of B2-type NaCl
in Journal of Applied Physics
Ammann M
(2008)
DFT study of migration enthalpies in MgSiO3 perovskite
in Physics and Chemistry of Minerals
GRINDROD P
(2008)
The long-term stability of a possible aqueous ammonium sulfate ocean inside Titan
in Icarus
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
Li L
(2009)
Ab initio molecular dynamics study of elasticity of akimotoite MgSiO3 at mantle conditions
in Physics of the Earth and Planetary Interiors
Brodholt John
(2009)
The rheological properties of post-perovskite and implications for D"
in GEOCHIMICA ET COSMOCHIMICA ACTA
Hunt S
(2009)
Deformation of olivine at 5GPa and 350-900°C
in Physics of the Earth and Planetary Interiors
Hunt S
(2009)
Weakening of calcium iridate during its transformation from perovskite to post-perovskite
in Nature Geoscience
Ammann Michael W.
(2009)
Absolute diffusion rates in MgSiO
3 perovskite and post-perovskite
in GEOCHIMICA ET COSMOCHIMICA ACTA
Li L
(2009)
Structure and elasticity of hydrous ringwoodite: A first principle investigation
in Physics of the Earth and Planetary Interiors
Hunt S
(2010)
Relative strength of the pyrope-majorite solid solution and the flow-law of majorite containing garnets
in Physics of the Earth and Planetary Interiors
Ammann MW
(2010)
First-principles constraints on diffusion in lower-mantle minerals and a weak D'' layer.
in Nature
Lindsay-Scott A
(2010)
The isothermal equation of state of CaPtO3 post-perovskite to 40GPa
in Physics of the Earth and Planetary Interiors
Stackhouse S
(2010)
Thermal conductivity of periclase (MgO) from first principles.
in Physical review letters
Côté A
(2010)
Ab initio lattice dynamics calculations on the combined effect of temperature and silicon on the stability of different iron phases in the Earth's inner core
in Physics of the Earth and Planetary Interiors
Ammann M
(2010)
Simulating Diffusion
in Reviews in Mineralogy and Geochemistry
Li L
(2011)
Ab initio molecular dynamic simulation on the elasticity of Mg3Al2Si3O12 pyrope
in Journal of Earth Science
Ammann M
(2011)
Ferrous iron diffusion in ferro-periclase across the spin transition
in Earth and Planetary Science Letters
| 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 |