Charge Density Difference Using VASPkit Command Line

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rkeesey
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Charge Density Difference Using VASPkit Command Line

#1 Post by rkeesey » Tue Jun 25, 2024 6:48 am

I am trying to run charge density difference calculations using VASPkit from my command line. When I enter:
vaspkit -task 314 -file CHGCAR_AB -file CHGCAR_A -file CHGCAR_B
I get an error message that the file is not
found. Is there a way that I can fix this? VASPkit runs correctly when I use the user interface, but I am trying to find a way where the 314 task can be run from the command line.
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pedro_melo
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Re: Charge Density Difference Using VASPkit Command Line

#2 Post by pedro_melo » Tue Jun 25, 2024 12:28 pm

Dear rkeesey,

I moved you post to the "From Users for Users" as we are not developers of VASPkit, so we cannot offer support for that software package. You must either contact their developer team or wait for other users to help you with this issue.

Kind regards,
Pedro
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