Configuration Set
HEA25S_high_entropy_alloys_dataset_B_bulk_md_train_step_3__CS_tyfuq13ypwyj_0
Name | HEA25S_high_entropy_alloys_dataset_B_bulk_md_train_step_3 |
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Extended ID | HEA25S_high_entropy_alloys_dataset_B_bulk_md_train_step_3__CS_tyfuq13ypwyj_0 |
Description | Configurations from the dataset_B_bulk_md: train_step_3 split of HEA25S_high_entropy_alloys |
Elements |
Co (6.48%) Fe (4.93%) Mn (6.57%) Ni (4.93%) Sc (2.84%) Ti (4.08%) Ag (3.91%) Rh (2.71%) Ir (3.47%) Zr (3.74%) Cr (7.3%) Nb (3.37%) Cu (5.75%) Mo (4.43%) Au (4.19%) V (4.08%) W (3.94%) Ru (3.86%) Pt (4.1%) Pd (4.2%) Zn (3.62%) Ta (2.8%) Lu (1.36%) Hf (1.58%) Y (1.74%) |
Number of Configurations | 450 |
Number of Atoms | 17,388 |
Configurations | |
Datasets |
DS_d5zht3ykr8hi_0 |
ColabFit ID | CS_tyfuq13ypwyj_0 |
Files | colabfitspec.json |
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