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Search results for parameter sweep
parameter-sweep
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4 search results found
Pwtools
⭐
53
pwtools is a Python package for pre- and postprocessing of atomistic calculations, mostly targeted to Quantum Espresso, CPMD, CP2K and LAMMPS. It is almost, but not quite, entirely unlike ASE, with some tools extending numpy/scipy. It has a set of powerful parsers and data types for storing calculation data.
Psweep
⭐
10
Loop like a pro, make parameter studies fun.
Submititnow
⭐
9
A "makeshift" toolkit to create and launch Jobs from existing python scripts on SLURM, and also monitor the status of current and past jobs.
Parasweep
⭐
5
Utility for facilitating parallel parameter sweeps
1-4 of 4 search results
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