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Tadah
MLIP
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2a7c32b86d19b8a55f49d0246db2120362ec85a1
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4
feature/structure_readers
develop
main
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protected
hpc
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mlip
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added mpi trainer include
Marcin Kirsz authored
5 months ago
2a7c32b8
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2a7c32b8
5 months ago
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Name
Last commit
Last update
analytics
design_matrix
models
output
tests
utils
.gitignore
.gitlab-ci.yml
CMakeLists.txt
LICENSE
README.md
atom.cpp
atom.h
descriptors_calc.h
descriptors_calc.hpp
descriptors_calc_base.h
nn_finder.cpp
nn_finder.h
normaliser.h
st_descriptors.cpp
st_descriptors.h
st_descriptors_db.cpp
st_descriptors_db.h
structure.cpp
structure.h
structure_db.cpp
structure_db.h
trainer.h
version.h
README.md
MLIP
