ICAMS

ICAMS's repositories

A Python library and command line interface for automated free energy calculations

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Kanapy is a python package for generating three-dimensional synthetic polycrystals based on characteristic microstructural features.

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TensorFlow based interface for ML potentials development, fitting and evaluation

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A lightweight python-based framework for high-throughput material simulation

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A python package for parametrizing and testing bond-order potentials and tight-binding models

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Python Laboratory for Finite Element Analysis

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Simple REST API interface to atomistictools.org website/database

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Limited-functionality version of pyace, including pacemaker

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Python Laboratory for Dislocation Dynamics

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Coupling of atomistic and XFEM regions: Study dislocations with atomic precision under well-defined mechanical boundary conditions

Language:CGPL-3.0000