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add accuracy regression tests under ext_tests; try to add all datasets from ACEpotentials paper and possibly more over time.
ext_tests
The text was updated successfully, but these errors were encountered:
First step is addressed by #244 . More tests can be added over time.
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add accuracy regression tests under
ext_tests
; try to add all datasets from ACEpotentials paper and possibly more over time.The text was updated successfully, but these errors were encountered: