WebI am a Research Fellow in the Department of Metallurgical and Materials Engineering, IIT Kharagpur. My broad area of interest is computational material science, and presently I am working on "Study of the structure and behaviour of crystal dislocations using Multi-Scale Materials Modelling." My research lies at the intersection of mechanical metallurgy, …

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WebI am a recent PhD graduate in Micro and Nano Scale Systems Engineering from Louisiana Tech University. I am interested in materials discovery and engineering, especially, through development and ... WebGeometry tools. class ase.geometry.Cell(array) [source] Parallel epipedal unit cell of up to three dimensions. This object resembles a 3x3 array whose [i, j]-th element is the jth Cartesian coordinate of the ith unit vector. Cells of less than three dimensions are represented by placeholder unit vectors that are zero. Create cell. how old is hurling

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WebMolecular dynamics (MD) simulations have been carried out to evaluate the mechanical properties of Cu nanoparticles under tensile and compressive load… WebOVITO’s Load trajectory modifier can read the varying bond topology from dump local or reax/c/bonds files and merge it with the molecular dataset. The loaded list of bonds will … WebTribological behaviors of diamond-like carbon (DLC) films with different levels of hierarchical surface textures with lubricant water molecules are investigated through molecular dynamics simulatio... mercury 150 outboard maintenance schedule