I'm Sarath Menon, currently a Research Associate at the Max Planck Institut für Eisenforschung. I love using C++ and python to write scientific programs. Find out more about me here.
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pyscal/pyscal
pyscal/pyscal PublicPython library written in C++ for calculation of local atomic structural environment
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ICAMS/calphy
ICAMS/calphy PublicA Python library and command line interface for automated free energy calculations
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pyiron/pylammpsmpi
pyiron/pylammpsmpi PublicParallel Lammps Python interface - control a mpi4py parallel LAMMPS instance from a serial python process or a Jupyter notebook
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pyscal/pyscal3
pyscal/pyscal3 PublicMore efficient and faster version of pyscal
Jupyter Notebook 12
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pyscal/atomRDF
pyscal/atomRDF PublicatomRDF is a python tool for ontology-based creation, manipulation, and quering of structures. atomRDF uses the Computational Material Sample Ontology (CMSO).
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