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Ab initio Calculations Using Wien2k Code

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How to plot the band structure using the case.bands.agr file created by wien2k code with origin software

Abderrahmane Al jazairi 12:00:00

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9 Comments

  1. Shahram Yalameha5 November 2017 at 01:13

    Hi.
    thank you.

    ReplyDelete
  2. Besma29 July 2019 at 10:29

    Can you help to plot it using magic plot software

    ReplyDelete
  3. Shahid kamran27 January 2020 at 20:24

    Hi dears , I am new here what is blogger system . J not know about it .
    And also note I need to learn wien2k here ..
    Kindly explain .
    ssskamranaerian@gmail.com
    +923344600944 what's app

    ReplyDelete
  4. Nora31 January 2020 at 17:29

    please what is the relationship between klist generated by xcrysden and the x axis found in bandstructure.agr to calculate energy and thanks in advance.

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    1. Abderrahmane REGGAD18 April 2021 at 19:00

      with wcrysden we create klist_band and after calculation we wiil get the bandstructure.agr file to be used in origin

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  5. Unknown6 February 2021 at 22:10

    How to find agr file when we draw band structure and how to create agr file

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    Replies
    1. Abderrahmane REGGAD18 April 2021 at 18:57

      when you plot the bandstructure using the w2web interface you will get this file to be used in origin

      Delete