Showing 1–12 of 12 results
/ Date/ Name
Aug 31, 2015First-principles study of configurational disorder in B$_{4}$C using a superatom-special quasirandom structure methodMar 7, 2016Fermi-liquid behavior and thermal conductivity of ε-iron at Earth's core conditionsFeb 21, 2002Screened Coulomb interactions in metallic alloys: II Screening beyond the single-site and atomic sphere approximationsJul 10, 2009High-pressure form of elemental boron is covalentApr 18, 2012Electronic properties and magnetism of iron at the Earth's inner core conditionsJun 2, 2003Van der Waals Density Functional for Layered StructuresJun 24, 2019Superionic-like diffusion in an elemental crystal: bcc TitaniumAug 28, 2019Impact of anharmonicity on sound wave velocities at extreme conditionsMar 29, 2011Lattice dynamics of anharmonic solids from first principlesOct 2, 2014Electronic correlations in Fe at Earth's inner core conditions: effect of doping with NiMar 7, 2002Stability of gold nanowires at large Au-Au separationsAug 31, 2015Configurational order-disorder induced metal-nonmetal transition in B$_{13}$C$_{2}$ studied with first-principles superatom-special quasirandom structure method