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ABINIT | GNU7/OpenMPI | https://www.abinit.org/ | ABINIT is a software suite to calculate the optical, mechanical, vibrational, and other observable properties of materials. Starting from the quantum equations of density functional theory, you can build up to advanced applications with perturbation theories based on DFT, and many-body Green's functions (GW and DMFT) . |
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Device
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, Process, Particle, and Finite Element Method Simulation
Archimedes/Rappture | https://www.gnu.org/software/archimedes https://nanohub.org/infrastructure/rappture | Archimedes belongs to the well-known family of TCAD software, i.e. tools utilized to assist the development of technologically relevant products. In particular, this package assists engineers in designing and simulating submicron and mesoscopic semiconductor devices. Rappture is the GUI for Archimedes. |
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DevSim | https://devsim.org/ | DEVSIM is semiconductor device simulation software which uses the finite volume method. It solves partial differential equations on a mesh. The Python interface allows users to specify their own equations. |
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Elmer | GNU7/OpenMPI | https://www.csc.fi/web/elmer/elmer | Elmer is an open source multiphysical simulation software mainly developed by CSC - IT Center for Science (CSC). Elmer development was started 1995 in collaboration with Finnish Universities, research institutes and industry. After it's open source publication in 2005, the use and development of Elmer has become international. Elmer includes physical models of fluid dynamics, structural mechanics, electromagnetics, heat transfer and acoustics, for example. These are described by partial differential equations which Elmer solves by the Finite Element Method (FEM). |
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HOOME-blue | Singularity | http://glotzerlab.engin.umich.edu/hoomd-blue/index.html https://glotzerlab-software.readthedocs.io/en/latest/software.html | HOOMD-blue is a general-purpose particle simulation toolkit. It scales from a single CPU to thousands. |
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OpenFOAM | https://openfoam.com | A Computational Fluid Dynamics (CFD) package. OpenFOAM has an extensive range of features to solve anything from complex fluid flows involving chemical reactions, turbulence and heat transfer, to solid dynamics and electromagnetics. |
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