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ML AFILT2

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ML_AFILT2 = [real]
Default: ML_AFILT2 = 0.002 

Description: This tag sets the filtering parameter for the angular filtering for ML_IAFILT2 in the machine learning force field method.


This tag is only used if ML_LAFILT2=.TRUE. and ML_IAFILT2=2 are used.

The angular filtering function[1] for ML_IAFILT2=2 is described as . The tag ML_AFILT2 sets the parameter .

References

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


Related Tags and Sections

ML_LMLFF, ML_LAFILT2, ML_IAFILT2

Examples that use this tag