[CP2K-user] How to write Effective core potentials from BSE website to CP2K potential file?

[toto Qian]

Dear all,

I have several questions for help.

   1. If I use def2 basis set, should I use def2 effective core potential 
   too? Can I just use Mo atom def2 TZVP basis set with GTH-PBE-q14 or 
   GTH-PADE-q14 Pseudopotentials?
   2. How to write Effective core potentials got from Basis Set Exchange 
   website into my CP2K potential file?
   3. If I use PBE XC function, can I use GTH-LDA-q14 Pseudopotentials?

Thank you in advance!


## Effective core potentials
> def2-TZVPD_ECP
> Mo nelec 28
> Mo ul
> 2      9.4500000            -24.80517707
> 2      4.7200000             -4.15378155
> Mo S
> 2      9.7145938            180.10310850
> 2      4.6805004             24.99722791
> 2      9.4500000             24.80517707
> 2      4.7200000              4.15378155
> Mo P
> 2      8.1421366            123.77275231
> 2      4.6259863             19.53022800
> 2      9.4500000             24.80517707
> 2      4.7200000              4.15378155
> Mo D
> 2      6.6184148             48.37502229
> 2      3.2487516              8.89205274
> 2      9.4500000             24.80517707
> 2      4.7200000              4.15378155
> END def2-TZVPD_ECP
>
>
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