Simon R Phillpot

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Simon R



Publications in SciGraph latest 50 shown

  • 2018-08-22 Entropy contributions to phase stability in binary random solid solutions in NPJ COMPUTATIONAL MATERIALS
  • 2018-02-06 Effects of grain boundaries on irradiation-induced defects in tungsten by molecular dynamics simulations in JOURNAL OF IRON AND STEEL RESEARCH INTERNATIONAL
  • 2018-01-28 Titanium-Carbide Formation at Defective Curved Graphene-Titanium Interfaces in MRS ADVANCES
  • 2017-10-17 Shock compression of CuxZr100−x metallic glasses from molecular dynamics simulations in JOURNAL OF MATERIALS SCIENCE
  • 2015-05-10 Effect of Temperature on the Friction and Wear of PTFE by Atomic-Level Simulation in TRIBOLOGY LETTERS
  • 2014-04-01 Role of cyberinfrastructure in educating the next generation of computational materials scientists in INTEGRATING MATERIALS AND MANUFACTURING INNOVATION
  • 2012-10-09 Low thermal conductivity oxides in MRS BULLETIN
  • 2012-05-26 Data-Driven Model for Estimation of Friction Coefficient Via Informatics Methods in TRIBOLOGY LETTERS
  • 2012-05-09 Variable charge many-body interatomic potentials in MRS BULLETIN
  • 2012-01-11 Critical assessment of UO2 classical potentials for thermal conductivity calculations in JOURNAL OF MATERIALS SCIENCE
  • 2011-09-24 Design of Low Wear Polymer Composites in TRIBOLOGY LETTERS
  • 2011-08-19 Thermal conductivity of UO2 fuel: Predicting fuel performance from simulation in JOM
  • 2011-03-11 Influence of the Molecular Level Structure of Polyethylene and Polytetrafluoroethylene on Their Tribological Response in TRIBOLOGY LETTERS
  • 2010-08-11 Effect of inversion on thermoelastic and thermal transport properties of MgAl2O4 spinel by atomistic simulation in JOURNAL OF MATERIALS SCIENCE
  • 2010-03-27 Effect of ionic polarizability on oxygen diffusion in δ-Bi2O3 from atomistic simulation in IONICS
  • 2010-01-01 Anisotropic thermal properties in orthorhombic perovskites in JOURNAL OF MATERIALS SCIENCE
  • 2009-08-14 Friction Properties of Carbon Nano-Onions from Experiment and Computer Simulations in TRIBOLOGY LETTERS
  • 2009-06 A computational study of SrTiO3 thin film deposition: Morphology and growth modes in JOURNAL OF MATERIALS RESEARCH
  • 2007-12 Effect of simulation conditions on friction in polytetrafluoroethylene (PTFE) in SCIENTIFIC MODELING AND SIMULATION SMNS
  • 2005-06 Interfacial thermal conductivity: Insights from atomic level simulation in JOURNAL OF MATERIALS SCIENCE
  • 2005-06 Order-disorder behavior in KNbO3 and KNbO3/KTaO3 solid solutions and superlattices by molecular-dynamics simulation in JOURNAL OF MATERIALS SCIENCE
  • 2005 Crystal Disordering in Melting and Amorphization in HANDBOOK OF MATERIALS MODELING
  • 2005 Interatomic Potentials: Ferroelectrics in HANDBOOK OF MATERIALS MODELING
  • 2003-12-14 Deformation-mechanism map for nanocrystalline metals by molecular-dynamics simulation in NATURE MATERIALS
  • 2003 Grain Rotation as a Mechanism of Grain Growth in Nanocrystalline Materials in TRENDS IN NANOSCALE MECHANICS
  • 2002-09-02 Dislocation processes in the deformation of nanocrystalline aluminium by molecular-dynamics simulation in NATURE MATERIALS
  • 2001 Molecular Dynamics Simulation of Nanocrystalline Pd under Stress in COMPUTER SIMULATION STUDIES IN CONDENSED-MATTER PHYSICS XIII
  • 1999-05 Atomistic Simulations of Integranular Fracture in Symmetric-Tilt Grain Boundaries in INTERFACE SCIENCE
  • 1999-05 Synthesis and Characterization of a Polycrystalline Ionic Thin Film by Large-Scale Molecular-Dynamics Simulation in INTERFACE SCIENCE
  • 1999 Structure and Properties of Polycrystalline Materials From Simulation: An Interfacial Perspective in MRS ADVANCES
  • 1998-09 On the Nature of Grain Boundaries in Nanocrystalline Diamond in MRS BULLETIN
  • 1998-08 Role of bonding and coordination in the atomic structure and energy of diamond and silicon grain boundaries in JOURNAL OF MATERIALS RESEARCH
  • 1997-11 Molecular-Dynamics Method for the Simulation of Grain-Boundary Migration in INTERFACE SCIENCE
  • 1997-11-01 Comparison Between Atomistic and Continuum-Mechanics Modelling of Grain-Boundary Fracture in MRS ADVANCES
  • 1997 Structural Disorder and Localized Gap States in Silicon Grain Boundaries from a Tight-Binding Model in MRS ADVANCES
  • 1997 Comparison of the Structure of Grain Boundaries in Silicon and Diamond by Molecular-Dynamics Simulations in MRS ADVANCES
  • 1995 Atomistic Simulation of Nanocrystalline Materials in MRS ADVANCES
  • 1994-03 Reconstruction of grain boundaries in copper and gold by simulation in JOURNAL OF MATERIALS RESEARCH
  • 1992-01-01 Reconstruction of Twist Grain Boundaries in Gold in MRS ADVANCES
  • 1991-11 On the mechanism of grain-boundary migration in metals: A molecular dynamics study in JOURNAL OF MATERIALS RESEARCH
  • 1991 Reconstruction of a High-Angle Twist Grain Boundary by Grand-Canonical Simulated Quenching in MRS ADVANCES
  • 1990-10 Effects of Atomic-Level Disorder at Solid Interfaces in MRS BULLETIN
  • 1990 Molecular-Dynamics Study of Grain-Boundary Migration in Metals in MRS ADVANCES
  • 1990 Calculation of Free Energy from the Internal-Energy Distribution Function in MRS ADVANCES
  • 1989 A Two Band Model for Halogen-Bridged Transition Metal Linear Chain Complexes in INTERACTING ELECTRONS IN REDUCED DIMENSIONS
  • 1989 Calculation of Local Elastic Constants at a Metallic Grain Boundary in MRS ADVANCES
  • 1989 Elastic Softening in Nanocrystalline Silicon in MRS ADVANCES
  • 1989 Grain-Boundary and Free-Surface Induced Thermodynamic Melting: A Molecular Dynamics Study in Silicon in ATOMISTIC SIMULATION OF MATERIALS
  • 1988-01 A New Model for the Simulation of Interfaces at High Temperature* in MRS ADVANCES
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