ML CSLOPE
ML_CSLOPE = [real]
Default: ML_CSLOPE =
Description: Parameter used in the automatic determination of threshold for Bayesian error estimation in the machine learning force field method.
For details please read entry ML_ICRITERIA first. The parameter ML_CTIFOR is only updated, if the absolute of the slope of the collected Bayesian errors is below ML_CSLOPE times the mean of the collected Bayesian errors. In practice, the slope and the standard errors are correlated: typically the standard error is at least twice the slope. We recommend to vary only ML_CSIG and keep ML_CSLOPE fixed to its default value.
Related Tags and Sections
ML_LMLFF, ML_ICRITERIA, ML_CSIG, ML_MHIS