Author Topic: Data set _ Suggested GGA / Partial Electron Density  (Read 794 times)

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Offline Dipankar Saha

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Data set _ Suggested GGA / Partial Electron Density
« on: January 1, 2020, 12:06 »
Hello,

1) For Plane Wave Calculator _QATK2019.12, if we select PAW pseudopotential method, we find various data sets as_
a) GPAW GGA
b) JTH GGA
c) Suggested GGA.

How are those different?


2) What is 'Partial Electron Density'?

Thanks and Regards_
Dipankar Saha



Offline Petr Khomyakov

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« Last Edit: January 3, 2020, 11:51 by Petr Khomyakov »

Offline Dipankar Saha

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Re: Data set _ Suggested GGA / Partial Electron Density
« Reply #2 on: January 3, 2020, 09:24 »
Thank you !  :)