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AMS-ICAMS-RUB
/
grace-foundation-models
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Atomistic Modelling and Simulation, Interdisciplinary Centre for Advanced Materials Simulation
1
tensorpotential
grace
interatomic-potential
molecular-dynamics
machine-learning-potential
materials-science
arxiv:
2602.23489
arxiv:
2508.17936
License:
academic-software-license
Model card
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xet
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main
grace-foundation-models
/
kokkos
4.33 GB
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1 contributor
History:
3 commits
yury-lysogorskiy
v6: initial (v0) r2SCAN fine-tunes of 2L-OMAT (MP-ALOE, MatPES); no UQ
454f1f3
verified
4 days ago
GRACE-1L-OMAT-large-base-kokkos.npz
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
123 MB
xet
v3 (uqv6) kokkos exports (raw, precision-agnostic)
3 months ago
GRACE-1L-OMAT-large-ft-AM-kokkos.npz
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
123 MB
xet
v3 (uqv6) kokkos exports (raw, precision-agnostic)
3 months ago
GRACE-1L-OMAT-large-ft-E-kokkos.npz
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
123 MB
xet
v3 (uqv6) kokkos exports (raw, precision-agnostic)
3 months ago
GRACE-1L-OMAT-medium-base-kokkos.npz
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
85.7 MB
xet
v3 (uqv6) kokkos exports (raw, precision-agnostic)
3 months ago
GRACE-1L-OMAT-medium-ft-AM-kokkos.npz
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
85.7 MB
xet
v3 (uqv6) kokkos exports (raw, precision-agnostic)
3 months ago
GRACE-1L-OMAT-medium-ft-E-kokkos.npz
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
85.7 MB
xet
v3 (uqv6) kokkos exports (raw, precision-agnostic)
3 months ago
GRACE-1L-SMAX-OMAT-large-kokkos.npz
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
130 MB
xet
v3 (uqv6) kokkos exports (raw, precision-agnostic)
3 months ago
GRACE-1L-SMAX-large-kokkos.npz
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
122 MB
xet
v3 (uqv6) kokkos exports (raw, precision-agnostic)
3 months ago
GRACE-2L-OMAT-large-base-kokkos.npz
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
240 MB
xet
v3 (uqv6) kokkos exports (raw, precision-agnostic)
3 months ago
GRACE-2L-OMAT-large-ft-AM-kokkos.npz
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
264 MB
xet
v3 (uqv6) kokkos exports (raw, precision-agnostic)
3 months ago
GRACE-2L-OMAT-large-ft-E-kokkos.npz
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
240 MB
xet
v3 (uqv6) kokkos exports (raw, precision-agnostic)
3 months ago
GRACE-2L-OMAT-large-ft-mpaloe-r2scan-v0-kokkos.npz
211 MB
xet
v6: initial (v0) r2SCAN fine-tunes of 2L-OMAT (MP-ALOE, MatPES); no UQ
4 days ago
GRACE-2L-OMAT-medium-base-kokkos.npz
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
227 MB
xet
v3 (uqv6) kokkos exports (raw, precision-agnostic)
3 months ago
GRACE-2L-OMAT-medium-ft-AM-kokkos.npz
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
227 MB
xet
v3 (uqv6) kokkos exports (raw, precision-agnostic)
3 months ago
GRACE-2L-OMAT-medium-ft-E-kokkos.npz
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
227 MB
xet
v3 (uqv6) kokkos exports (raw, precision-agnostic)
3 months ago
GRACE-2L-SMAX-OMAT-large-kokkos.npz
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
253 MB
xet
v3 (uqv6) kokkos exports (raw, precision-agnostic)
3 months ago
GRACE-2L-SMAX-OMAT-medium-kokkos.npz
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
240 MB
xet
v3 (uqv6) kokkos exports (raw, precision-agnostic)
3 months ago
GRACE-2L-SMAX-large-kokkos.npz
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
262 MB
xet
v3 (uqv6) kokkos exports (raw, precision-agnostic)
3 months ago
GRACE-2L-SMAX-medium-kokkos.npz
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
225 MB
xet
v3 (uqv6) kokkos exports (raw, precision-agnostic)
3 months ago
GRACE-3L-OMAT-large-ft-AM-kokkos.npz
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
441 MB
xet
v4 (uqv6) GRACE-3L release: fp32 models, checkpoints, kokkos, changelog
3 months ago
GRACE-3L-OMAT-large-kokkos.npz
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
398 MB
xet
v4 (uqv6) GRACE-3L release: fp32 models, checkpoints, kokkos, changelog
3 months ago
