activity
19972016
most citedEwald methods for polarizable surfaces with application to hydroxylation and hydrogen bonding on the (012) and (001) surfaces of alpha-Fe2O3

111 citations · 112 across the 10 of their papers we have counts for

collaborators
Showing 2008 · cond-mat.mtrl-sciShow all

1 paper · 2 filters

cond-mat.mtrl-sci2008

The effect of pressure and spin on the isotopic composition of ferrous iron dissolved in periclase and silicate perovskite

James R. Rustad, Piotr Zarzycki, Maryali P. Sauceda +1

We perform density functional calculations of the equilibrium 57Fe/54Fe ratios for ferrous iron dissolved in periclase and MgSiO3 perovskite at the pressures and temperatures of th…