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Description
Starting on the 4th of March around 9pm we noticed that the download of the GRACE-2L-OAM_28Jan25 model changed when calling:
grace_models download GRACE_2L_OAM_28Jan25
With the new model the ASE interface breaks down and we get the following error message:
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Traceback (most recent call last):
File "/home/runner/work/atomistics/atomistics/tests/test_ase_interface/test_evcurve_ase_grace.py", line 27, in test_calc_evcurve
ase_calculator = grace_fm("GRACE_2L_OAM_28Jan25")
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "/home/runner/miniconda3/envs/test/lib/python3.11/site-packages/tensorpotential/calculator/foundation_models.py", line 144, in grace_fm
calc = TPCalculator(
^^^^^^^^^^^^^
File "/home/runner/miniconda3/envs/test/lib/python3.11/site-packages/tensorpotential/calculator/asecalculator.py", line 334, in __init__
{k: v for k, v in zip(element_map_symbols, element_map_index)}
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
TypeError: 'NoneType' object is not iterable
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I uploaded the original working version to https://github.com/jan-janssen/GRACE-2L-OAM_28Jan25
anyangml and caic99
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