Browsing Code Catalog by Issue Date

Now showing items 41-60 of 72

    • DICTRA 

      Thermo-Calc Software AB
      DICTRA is an add-on module to Thermo-Calc for the accurate simulation of diffusion controlled reactions in multicomponent alloy systems. DICTRA is based on the numerical solution of the multicomponent diffusion equations ...

    • MTEX: A MATLAB Toolbox for Quantitative Texture Analysis 

      Ralf Hielscher
      MTEX is a MATLAB toolbox that allows to solve a wide range of problems in quantitative texture analysis. This includes: crystal geometry, ODF modeling, textrue calculations, pole figure diffraction data, pole fiture to ODF ...

    • FiPy: A Finite Volume PDE Solver Using Python 

      NIST MML; Warren, James A.; Wheeler, Daniel; Guyer, Jonathan
      The FiPy framework includes terms for transient diffusion, convection and standard sources, enabling the solution of arbitrary combinations of coupled elliptic, hyperbolic and parabolic PDEs. Currently implemented models ...

    • OOF: Finite Element Analysis of Microstructures 

      NIST ITL
      OOF is designed to help materials scientists calculate macroscopic properties from images of real or simulated microstructures. It reads an image, assigns material properties to features in the image, and conducts virtual ...

    • FPLO 

      Klaus Koepernik K.Koepernik@ifw-dresden.de
      "The FPLO package is a full-potential local-orbital minimum-basis code [1] [2] to solve the Kohn-Sham equations on a regular lattice [6]. The situation of a chemically disordered structure is covered by a CPA solver [3], ...

    • DACAPO 

      Marcin Dulak
      This tool performs calculations for Local Density Approximation (LDA) and Generalized Gradient Approximation (GGA) exchange-correlations potentials as well as various molecular dynamics calculations. Dacapo is a total ...

    • Atomistic Stress Simulator (WARP) 

      Steve Plimpton
      WARP is a parallel molecular dynamics simulation code for modeling stress and strain in materials using embedded atom method (EAM) and Lennard-Jones (LJ) potentials. It is written in F90 and performs message-passing via ...

    • FLEUR 

      Stefan Blugel
      "This is the homepage of FLEUR, a feature-full, freely available FLAPW (full potential linearized augmented planewave) code, based on density-functional theory. The FLAPW-Method (Full Potential Linearized Augmented Plane ...

    • FactSage 

      Thermfact/CRCT; GTT-Technologies
      FactSage©, one of the largest fully integrated database computing systems in chemical thermodynamics in the world, was introduced in 2001 and is the fusion of the FACT-Win/F*A*C*T and ChemSage/SOLGASMIX thermochemical packages.

    • FORGE NxT 

      Transvalor
      This software can simulate hot, warm, and cold forging of both 3D parts and 2D geometry parts, using different process settings and/or different die designs. Accurate predictions are then made for the dies (wear, damage, ...

    • Vienna Ab-Initio Simulation Package (VASP) 

      VASP Group at University of Vienna (Austria): Jürgen Hafner; Georg Kresse; Doris Vogtenhuber; Martijn Marsman
      The Vienna Ab initio Simulation Package (VASP) is a computer program for atomic scale materials modelling, e.g. electronic structure calculations and quantum-mechanical molecular dynamics, from first principles. VASP ...

    • microMegas (mM) 

      CNRS-ONERA, France
      MicroMegas is a 3-D DDD (Discrete Dislocation Dynamics) simulation. MicroMegas (also known as 'mM') is an open source program for DD (Dislocation Dynamics) simulations originally developed at the 'Laboratoire d'Etude des ...

    • Ternary 

      Adam Powell
      Ternary is a free energy visualization tool. Inspired by Craig Carter's Mathematica scripts for binary mixtures, it uses qhull to calculate the convex hull of the free energy curve, and visualizes the result including ...

    • Gaussian 

      Gaussian Inc.
      "Gaussian 09 is the latest version of the Gaussian® series of electronic structure programs, used by chemists, chemical engineers, biochemists, physicists and other scientists worldwide. Starting from the fundamental laws ...

    • Virtual Performance Solution 

      ESI Group
      Virtual Performance Solution (VPS) is a global solution for Virtual Product Engineering, which has its origins in PAM-CRASH, and takes into account multiple domains. One of the top commercial products for crash simulations ...

    • COMSOL 

      COMSOL Inc
      The COMSOL Multiphysics simulation software environment facilitates all steps in the modeling process − defining your geometry, meshing, specifying your physics, solving, and then visualizing your results.

    • Flow-3D 

      Flow Science Inc.
      FLOW-3D is a powerful and highly-accurate CFD software that facilitates the simulation and analysis of many physical flow processes.

    • Poseidon 

      Sungho Kim
      A concurrent multi-scale simulation program using molecular dynamic simulation and density functional theory calculation. Research version is available to CAVS (Mississippi State University) researchers only.

    • DYNAMO 

      Unknown author
      DYNAMO is commonly used for MEAM (modified embedded atom method) interatomic potential generation. Alternative to LAMMPS.

    • MSU ISV Plasticity-Damage Model 

      M. Horstemeyer; R. Carino; Y. Hammi; K. Solanki
      "The Mississippi State University Internal State Variable (ISV) plasticity-damage model (DMG) production version 1.0 is being released along with its model calibration tool (DMGfit). The model equations and material model ...