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Package Usage: pypi: gaussianrunner
A script to run Gaussian automatically.
9 versions
Latest release: over 4 years ago
1 dependent package
98 downloads last month
View more package details: https://packages.ecosyste.ms/registries/pypi.org/packages/gaussianrunner
View more repository details: https://repos.ecosyste.ms/hosts/GitHub/repositories/njzjz%2Fgaussianrunner
Dependent Repos 1
tongzhugroup/aimdfragmentation
A automated fragmentation method for Ab Initio Molecular Dynamics (AIMD).- >=1.0.19 setup.py
Size: 129 KB - Last synced: 10 months ago - Pushed: almost 3 years ago
tongzhugroup/mddatasetbuilder
A script to build reference datasets for training neural network potentials from given LAMMPS trajectories.- >=1.0.20 pyproject.toml
Size: 279 KB - Last synced: 8 days ago - Pushed: 9 days ago
