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I have put a subdirectory into pseudoPotLibs called PSlibrary_v1.0.0
The files are in /PSEUDOPOTENTIALS (e.x. ./pbe/PSEUDOPOTENTIALS, ./pz/PSEUDOPOTENTIALS)
Then I have a green colour on Pseudopotential Lib (./pseudoPotLibs)
But in the Pseudopotential settings if I select
Library:PSLIBRARY
Functional: PBE
Then I have the possibility to choose PAW or Ultrasoft and for Cutoff low or high but the Pseudopotencial cell is always in red. The string written in the cell is PSlibrary_v1.0.0/Si.pbe....
I'm afraid that the program is looking for in the wrong site! should be PSlibrary_v1.0.0/pbe/PSEUDOPOTENTIALS/Si.pbe....
The text was updated successfully, but these errors were encountered:
I have put a subdirectory into pseudoPotLibs called PSlibrary_v1.0.0
The files are in /PSEUDOPOTENTIALS (e.x. ./pbe/PSEUDOPOTENTIALS, ./pz/PSEUDOPOTENTIALS)
Then I have a green colour on Pseudopotential Lib (./pseudoPotLibs)
But in the Pseudopotential settings if I select
Library:PSLIBRARY
Functional: PBE
Then I have the possibility to choose PAW or Ultrasoft and for Cutoff low or high but the Pseudopotencial cell is always in red. The string written in the cell is PSlibrary_v1.0.0/Si.pbe....
I'm afraid that the program is looking for in the wrong site! should be PSlibrary_v1.0.0/pbe/PSEUDOPOTENTIALS/Si.pbe....
The text was updated successfully, but these errors were encountered: