SCSRAD

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SCSRAD = [real]
Default: SCSRAD = 120 

Description: SCSRAD defines the cutoff radius (in ) used in the calculation of within the Tkatchenko-Scheffler method Self-consistent screening in Tkatchenko-Scheffler method.


Related tags and articles

Self-consistent screening in Tkatchenko-Scheffler method

Examples that use this tag