Ab initiosimulations of MgO under extreme conditions

Experimental evidence for a phase transition in magnesium oxide at exoplanet pressures

(2013) F. Coppari et al.   Nature Geoscience

Demixing Instability in Dense MoltenMgSiO3and the Phase Diagram of MgO

(2013) Brian Boates et al.   PHYSICAL REVIEW LETTERS

Probing the Interiors of the Ice Giants: Shock Compression of Water to 700 GPa and3.8  g/cm3

(2012) M. D. Knudson et al.   PHYSICAL REVIEW LETTERS

Rocky Core Solubility in Jupiter and Giant Exoplanets

(2012) Hugh F. Wilson et al.   PHYSICAL REVIEW LETTERS

Phase Transformations and Metallization of Magnesium Oxide at High Pressure and Temperature

(2012) R. S. McWilliams et al.   SCIENCE

Thermal and transport properties of mantle rock at high pressure: Applications to super-Earths

(2011) Vlada Stamenković et al.   ICARUS

Electronic transport coefficients fromab initiosimulations and application to dense liquid hydrogen

(2011) Bastian Holst et al.   PHYSICAL REVIEW B

Optical properties of water at high temperature

(2011) Martin French et al.   PHYSICS OF PLASMAS

Thermal conductivity of MgO periclase at high pressure: Implications for the D″ region

(2010) Nico de Koker   EARTH AND PLANETARY SCIENCE LETTERS

Rheological structure of the mantle of a super-Earth: Some insights from mineral physics

(2010) Shun-ichiro Karato   ICARUS

MgO phase diagram from first principles in a wide pressure-temperature range

(2010) A. B. Belonoshko et al.   PHYSICAL REVIEW B

Diffusion and electrical conductivity in water at ultrahigh pressures

(2010) Martin French et al.   PHYSICAL REVIEW B

PHON: A program to calculate phonons using the small displacement method

(2009) Dario Alfè   COMPUTER PHYSICS COMMUNICATIONS

Self-consistent thermodynamic description of silicate liquids, with application to shock melting of MgO periclase and MgSiO3perovskite

(2009) Nico de Koker et al.   GEOPHYSICAL JOURNAL INTERNATIONAL

Thermal Conductivity of MgO Periclase from Equilibrium First Principles Molecular Dynamics

(2009) Nico de Koker   PHYSICAL REVIEW LETTERS

Ab Initio Equation of State Data for Hydrogen, Helium, and Water and the Internal Structure of Jupiter

(2008) Nadine Nettelmann et al.   ASTROPHYSICAL JOURNAL

Melting behavior of (Mg,Fe)O solid solutions at high pressure

(2008) Li Zhang et al.   GEOPHYSICAL RESEARCH LETTERS

The AM05 density functional applied to solids

(2008) Ann E. Mattsson et al.   JOURNAL OF CHEMICAL PHYSICS

First-principles calculations of the ferroelastic transition between rutile-type andCaCl2-typeSiO2at high pressures

(2008) Atsushi Togo et al.   PHYSICAL REVIEW B

Restoring the Density-Gradient Expansion for Exchange in Solids and Surfaces

(2008) John P. Perdew et al.   PHYSICAL REVIEW LETTERS