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Difference between revisions of "ML FF AFILT2 MB"

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[[Category:INCAR]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]][[Category:VASP6]]
[[Category:INCAR]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]][[Category: Alpha]]

Latest revision as of 15:14, 29 February 2020

ML_FF_AFILT2_MB = [real]
Default: ML_FF_AFILT2_MB = 0.002 

Description: This tag sets the filtering parameter for the angular filtering for ML_FF_IAFILT2_MB in the machine learning force field method.

This tag is only used if ML_FF_LAFILT2_MB=.TRUE. and ML_FF_IAFILT2_MB=2 are used.

The angular filtering function[1] for ML_FF_IAFILT2_MB=2 is described as . The tag ML_FF_AFILT2_MB sets the parameter .


  1. [ J. P. Boyd, Chebyshev and Fourier Spectral Methods (Dover Publications, New York, 2000).]

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