hujay2019

Pinned Repositories

aiida-phonopy
Phonon for AiiDA
Language:Python18 4 917
aiida-core
The official repository for the AiiDA code
Language:Python0 0 00
aiida-phonopy
Phonon for AiiDA
Language:Python00
aiida-vasp
A plugin to AiiDA for running simulations with VASP
Language:Python0 0 00
PhononFlow
A collection of tips, scripts, tools, and files to enable a better workflow for phonon calculations using VASP and phonopy.
Language:Shell0 0 00
pysqa
Simple HPC queuing system adapter for Python on based jinja templates to automate the submission script creation.
Language:Python00
database-hhpm
Database of Hybrid Halide Perovskite Monolayers
00
workflow-hhpm
Workflow for Automated Design of Hybrid Halide Perovskite Monolayers
Language:Python00
pyiron
pyiron - an integrated development environment (IDE) for computational materials science.
Language:Jupyter Notebook379 16 33550
pysqa
Simple HPC queuing system adapter for Python on based jinja templates to automate the submission script creation.
Language:Python24 6 317

hujay2019's Repositories

hujay2019/aiida-core
The official repository for the AiiDA code
Language:Python0 0 00
hujay2019/aiida-phonopy
Phonon for AiiDA
Language:Python00
hujay2019/aiida-vasp
A plugin to AiiDA for running simulations with VASP
Language:Python0 0 00
hujay2019/PhononFlow
A collection of tips, scripts, tools, and files to enable a better workflow for phonon calculations using VASP and phonopy.
Language:Shell0 0 00
hujay2019/pysqa
Simple HPC queuing system adapter for Python on based jinja templates to automate the submission script creation.
Language:Python00