Dear Prof Peter Blaha,

thank you for your feedback. I'm sorry for such a vague question.

Nevertheless, you have given me the answer I need.

I was looking for the sperically averaged density as function of distance from the nucleus and now I see that the .clmsum file is exactly it.

If possible, please answer one more question, where can I find a radial mesh values for r^2 * C_00(r) specified in this file?


Best regards,
Artem Tarasov
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