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jgrogan 684f81980d Initial hpc batch submission script and clean whitespace in umat.
2024-06-04 12:32:16 +01:00
..
batch_submission Initial hpc batch submission script and clean whitespace in umat. 2024-06-04 12:32:16 +01:00
Activity.py Add scripts and inp files. 2024-05-13 20:50:21 +01:00
CDIE_1E.inp Add scripts and inp files. 2024-05-13 20:50:21 +01:00
CP_Generator_30_3D.py Add scripts and inp files. 2024-05-13 20:50:21 +01:00
GenerateMaterials.py Add scripts and inp files. 2024-05-13 20:50:21 +01:00
mag1.inp Add scripts and inp files. 2024-05-13 20:50:21 +01:00
Orientations.py Add scripts and inp files. 2024-05-13 20:50:21 +01:00
README.md Initial hpc batch submission script and clean whitespace in umat. 2024-06-04 12:32:16 +01:00
steel1.inp Add scripts and inp files. 2024-05-13 20:50:21 +01:00
UCrys_HCP_Only.for Initial hpc batch submission script and clean whitespace in umat. 2024-06-04 12:32:16 +01:00
VCrys_HCP_Only.for Add scripts and inp files. 2024-05-13 20:50:21 +01:00

README.md

Journal Article: https://doi.org/10.1016/j.jmbbm.2014.01.007

Supporting Data - including original software versions: https://zenodo.org/records/11184080