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Author:
Rohit Goswami
License:
BSD-3-Clause
Summary:
Nanobind bindings to the eOn C++ client (Matter, Parameters, Potential, Jobs, NEB, RGPOT)
Latest version:
0.4.2
Required dependencies:
numpy
|
readcon
Optional dependencies:
ase
|
eon-schema
|
metatensor
|
metatensor-torch
|
metatomic-torch
|
pyeonclient
|
rgpot
|
rgpycrumbs
|
torch
|
vesin
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