Showing 1–20 of 23 results
/ Date/ Name
Feb 17, 2019Native point defects from stoichiometry-linked chemical potentials in cubic boron arsenideJan 7, 2012Fast Free Energy Calculations for Unstable High-Temperature PhasesJan 15, 2019Ferromagnetic Epitaxial μ-Fe$_{2}$O$_{3}$ on β-Ga$_{2}$O$_{3}$: A New Monoclinic form of Fe$_{2}$O$_{3}$Apr 21, 2011First principles calculation of polarization induced interfacial charges in GaN/AlN heterostructuresAug 24, 2020Bond Synergy Model for Bond Energies in Alloy OxidesJul 8, 2022Ab-Initio Simulation of Field EvaporationOct 19, 2021Non-Linear Arrhenius Behavior of Self-Diffusion in $β$-Ti and MoJun 26, 2017Magnetic Proximity Effect in Pt/CoFe2O4 BilayersSep 13, 2022Origin of Enhanced Zone Lines in Field Desorption MapsNov 9, 2018Multi-Cell Monte Carlo Method for Phase PredictionOct 26, 2010Full first-principles theory of spin relaxation in group-IV materialsOct 25, 2017NaSn2As2: An Exfoliatable Layered van der Waals Zintl PhaseJun 29, 2016Improved model for the thermal conductivity of binary metallic systemsMar 10, 2026Frontiers of atom probe tomography physics, data processing, and analysisAug 3, 2022Rapid Production of Accurate Embedded-Atom Method Potentials for Metal AlloysSep 4, 2012Rapid Production of Accurate Embedded-Atom Method Potentials for Metal AlloysDec 23, 2023New three-dimensional dispersion in the type-II Dirac semimetals PtTe$_2$ and PdTe$_2$ revealed through Angle Resolved Photoemission SpectroscopyAug 3, 2022Bayesian calibration of interatomic potentials for binary alloysMay 9, 2013Structural evolution and kinetics in Cu-Zr Metallic LiquidsMay 23, 2018Raman Spectroscopy, Photocatalytic Degradation and Stabilization of Atomically Thin Chromium Triiodide