[Pw_forum] kpoint_grid & npk

[Paul M. Grant]

To All.where is the default for npk set that is fed to kpoint_grid and what
governs the choice?  For a MP grid of 100^3 that's only a million! (just
kidding ;).)

 

Paul M. Grant, PhD

Principal, W2AGZ Technologies

Visiting Scholar, Applied Physics, Stanford University

EPRI Science Fellow (Retired)

IBM Research Staff Member Emeritus

 <mailto:w2agz at pacbell.net> w2agz at pacbell.net

 <http://www.w2agz.com/> http://www.w2agz.com

 

 

 

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