Hello, Gau-PBE hybrid functional works with Grimme D2 correction, but not with D3. I got the message: program stopped due to: functional name unknown must stop!
Actually, it is a limitation of the dft-d3 program (path-to-qe/dft-d3/core.f90), in order to define rs6, s18 and rs18 parameters. Many cases are available, meaning many functionals recognized, with a set of the above parameter for everyone, but not for Gau-PBE. Is there a place where those values are available for Gau-PBE? Thank you, Xavier
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