[CP2K-user] [CP2K:20277] Write the initial guess of the KS matrix to file

[Paolo Pegolo]

Dear CP2K community,

I'd like to print to file the initial guess for the KS matrix, i.e.,  the 
initial one, before any SCF iteration is performed. I tried different 
keyword combinations in the FORCE_EVAL/DFT/PRINT/KS_CSR_WRITE section but 
nothing gets printed if I set MAX_SCF to 0.

Is there a way of writing the initial guess to file?

Thank you.

Best,
Paolo

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