Difference between revisions of "Smooth"

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Revision as of 07:40, 24 June 2021

The smooth keyword is an optional keyword in the input file. It takes 1 logical argument, .true. or .false.. When used, it applies a LOWESS filter to smooth out the DoS. This can help stabilize entropy calculations with insufficient sampling due to the noise in the DoS. The locality of the smoothing is optionally tuned with the sigma_nu keyword. See an example below:

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Summary

Summary for temperature keyword
Required/optional Type Accepted values Default See also
Optional Logical .true. .false. Input file, sigma_nu

Example

smooth = .true.