ML ABN: Difference between revisions
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This file contains the same format and information as the {{TAG|ML_ABCAR}} file. The {{TAG|ML_ABCAR}} file is used as an input for continuation runs ({{TAG|ML_FF_ISTART}}=1 or 2). After the calculation is finished the updated information is output to the {{TAG|ML_ABNCAR}} file. This file should be then simply copied to the {{TAG|ML_ABCAR}} file for the nex continuation run. | |||
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[[Category:Files]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]][[Category:Output Files]][[Category:VASP6]] | [[Category:Files]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]][[Category:Output Files]][[Category:VASP6]] | ||
Revision as of 10:06, 5 June 2019
This file contains the same format and information as the ML_ABCAR file. The ML_ABCAR file is used as an input for continuation runs (ML_FF_ISTART=1 or 2). After the calculation is finished the updated information is output to the ML_ABNCAR file. This file should be then simply copied to the ML_ABCAR file for the nex continuation run.