[CP2K-user] [CP2K:21245] Au compatible basis set for q1 pseudopotential

[Chengyuan Shao]

Hi all,

I am new to CP2K and trying to do some calculation for gold cluster. I 
found a "GTH-PBE-q1" pseudopotential for gold (or GTH-PADE-q1) treating 
gold with only one valence electron. However, I could not find any 
compatible basis set for it. There are q11 and q19 basis sets but no q1.

Is this a normal situation for CP2K? If they created q1 pp, shouldn't there 
be at least one compatible basis set?

Best,
Jack

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