Research Scientist @LLNL
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parsevasp Public
Forked from aiida-vasp/parsevaspA general parser for VASP
Python MIT License UpdatedMay 6, 2025 -
aiida-registry Public
Forked from aiidateam/aiida-registryFind plugins for AiiDA
Python Other UpdatedOct 11, 2024 -
aiida-environ Public
Forked from environ-developers/aiida-environ -
aiida-ase Public
Forked from aiidaplugins/aiida-aseAiiDA plugin for ASE
Python MIT License UpdatedSep 5, 2024 -
This is a mirror. Please check our main website on gitlab.
C++ Mozilla Public License 2.0 UpdatedAug 28, 2024 -
ExaEpi Public
Forked from AMReX-Agent/ExaEpiAn agent-based epidemiological simulation code using AMReX
Jupyter Notebook Other UpdatedMar 18, 2024 -
merlin-spellbook Public
Forked from LLNL/merlin-spellbookUseful utilities for merlin workflows!
Python MIT License UpdatedJan 19, 2023 -
merlin Public
Forked from LLNL/merlinMachine Learning for HPC Workflows
Python MIT License UpdatedDec 15, 2022 -
aiida-core Public
Forked from aiidateam/aiida-coreThe official repository for the AiiDA code
Python Other UpdatedMay 30, 2022 -
aiida-nwchem Public
Forked from aiidateam/aiida-nwchemAiiDA plugin for NWChem
Python MIT License UpdatedJul 8, 2021 -
pymatgen Public
Forked from materialsproject/pymatgenPython Materials Genomics (pymatgen) is a robust materials analysis code that defines core object representations for structures and molecules with support for many electronic structure codes. It i…
HTML MIT License UpdatedJun 23, 2021