[CP2K-user] [CP2K:17931] Availability of 1 electron Au basis set

uca...@ucl.ac.uk ucapca1 at ucl.ac.uk
Sun Oct 23 10:28:31 UTC 2022

Dear all,

There are a number of 1 electron Au pseudopotentials such as GTH-PADE-q1 in 
data/GTH_POTENTIALS and GTH-PBE-q1 in data/POTENTIAL_UZH, however I have 
been unable to find any corresponding basis sets. Does anybody have a 1 
electron Au basis set?


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