ML ABN: Difference between revisions
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This file contains the same format and information as the {{TAG|ML_AB}} file. The {{TAG|ML_AB}} file is used as an input for continuation runs ({{TAG|ML_ISTART}}=1 or | This file contains the same format and information as the {{TAG|ML_AB}} file. The {{TAG|ML_AB}} file is used as an input for continuation runs ({{TAG|ML_ISTART}}=1 or 3). After the calculation is finished the updated information is output to the {{TAG|ML_ABN}} file. For a continuation run this file should be simply copied to the {{TAG|ML_AB}} file. | ||
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[[Category:Files]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]][[Category:Output Files]][[Category:Alpha]] | [[Category:Files]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]][[Category:Output Files]][[Category:Alpha]] | ||
Revision as of 08:20, 23 August 2021
This file contains the same format and information as the ML_AB file. The ML_AB file is used as an input for continuation runs (ML_ISTART=1 or 3). After the calculation is finished the updated information is output to the ML_ABN file. For a continuation run this file should be simply copied to the ML_AB file.