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mitsuaki1987 / sctk

Superconducting-Toolkit (SCTK) is a first-principles program package based on density functional theory for superconductors (SCDFT)
https://mitsuaki1987.github.io/sctk/
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Superconducting gap vs. temperature #18

Open phyczhang opened 6 months ago

phyczhang commented 6 months ago

Dear All,

I wonder how to calculate the superconducting gap vs. temperature. According to tutorial, after running SCDFT with calculation = "scdft", it will output delta.dat file. However I cannot find the delta.dat file. Does anyone have any advice on this issue?

Ang comments and suggestions are welcomed.

Thanks and Regards, Chao

jgSi1113 commented 6 months ago

You'd better check the outdir you set. v6.4 should copy the delta.dat from the outdir to the folder which contains sctk_input.file or the folder you submitted your job.

Best, Jianguo