Problem of INFO_KSUM

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TONGRUI LI

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Jun 14, 2022, 11:16:43 PM6/14/22
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Hello Mr. Hyowon Park, after I run the DFT  with vasp and wannier90 fitted DFT band, I had a error when RUNDMFT.py execution, found that the INFO_KSUM this file is only one line,

    # mu     TOT_ELEC        Nd[0]       Nd[-1]         EKIN    Sigoo-Vdc     <d_epsk>'

 and then reported the error that DMFT. EKIN0 = float(lines[-1].split()[4])
ValueError: could not convert string to float: Nd[-1], 
    I want to know how to fix it?


  Best,
Tongrui

Uthpala Herath

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Jun 20, 2022, 6:03:22 PM6/20/22
to TONGRUI LI, DMFTwDFT
Dear Tongrui, 

Can you send me your DMFT directory, please?
I can see what's going on. 

Thanks,

Best,
Uthpala

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Uthpala Herath
Postdoctoral Associate
Department of Mechanical Engineering and Materials Science
Duke University
Durham, NC

TONGRUI LI

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Jul 15, 2022, 11:03:40 PM7/15/22
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    Thanky you,Dear Uthpala, I've already sent the file to you from my personal email address  9347...@qq.com,  I would appreciate it if you had time to check it for me
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