Tags: computational materials science

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Computational materials science is the application of computational methods alone or in conjunction with experimental techniques to discover new materials and investigate existing materials such as: metals, ceramics, composites, semiconductors, nanostructures, 2D materials, metamaterials, polymers, liquid crystals, surfactants, emulsions, polymer nanocomposites, nanocrystal superlattices and nanoparticles.

Wiki Pages (1-2 of 2)

  1. Molecular dynamics simulations of materials

    Wiki

    What is MD? Molecular dynamics involves the numerical solution of the classical equations of motion (F=ma) for every single atom in material. The result is a very detailed description of the...

    https://nanohub.org/wiki/MD

  2. Learning Module: Atomic Picture of Plastic Deformation in Metals

    Wiki

    The main goal of this learning module is to introduce students to the atomic-level processes responsible for plastic deformation in crystalline metals and help them develop a more intuitive...

    https://nanohub.org/wiki/LearningModulePlasticityMD