[CP2K-user] Adding DFT-D3 paramter for Am
luju... at gmail.com
Sat Sep 5 06:30:30 UTC 2020
Dear all CP2K experts,
I want to use dft-d3 parameter for Am element in CP2K. But there is no
dftd3 parameter for Am. Currently, I want to use parameters of Pu to
sustitute Am. But I do not know how to revise dftd3.dat. Could anyone help
me? I would be very appreciated!
With my best regards,
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