How to install Quantum Espresso in Ubuntu/ Linux_The Easiest Approach

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  • Опубликовано: 1 дек 2024

Комментарии • 44

  • @Rgbutubeuser
    @Rgbutubeuser Год назад +3

    Thankyou sir, please upload its 2nd part i.e. demo for qe calculation

  • @mdborhanuddin8295
    @mdborhanuddin8295 Год назад +2

    Thank you sir. Besides making videos on qe, please make a video on how to install boltztrap in qe.

  • @dr.n.tsogbadrakh3812
    @dr.n.tsogbadrakh3812 2 месяца назад +1

    Hello, after the installation of the Quantum Espresso, the Quantum Espresso works as a serial version. But it is not working as parallel version. Why is it?

    • @theoreticalcmp
      @theoreticalcmp  2 месяца назад

      It need customized treatment. You may mail me in thrtclcmp@gmail.com.

  • @mazharhaleemawan7
    @mazharhaleemawan7 Год назад +1

    Great Sir

  • @mahendragoddati3892
    @mahendragoddati3892 Год назад +1

    Thank you, I installed it but how to see and/or open the QE (installed one)?

    • @theoreticalcmp
      @theoreticalcmp  Год назад +1

      You don't have to open it. Just run any code (input file) based on it.

  • @alfredodanielsanchez1081
    @alfredodanielsanchez1081 3 месяца назад

    Hello, thanks for the nice video. I am using Ubuntu 24.04 and I am a little bit confused on the way to install the packages. In different websites are different way to do it. Some of them list commands in terminal, and others say something similar you exposed in the video.

  • @GrgAGamingHub
    @GrgAGamingHub Год назад +1

    there is problem when i try to install qe...whenever i try to install fftw3 package it says 'unable to locate package fftw3'....what should i do?

  • @PhysicsClassForYou
    @PhysicsClassForYou 8 месяцев назад

    Nice video sir. For submitting job in parallel do I need to submit as mpirun -np no of cores pw.x input.in > output.out. Am I write?

  • @kkm-ot1ls
    @kkm-ot1ls 8 месяцев назад

    Could you kindly explain the installation of QE on windows?

    • @theoreticalcmp
      @theoreticalcmp  8 месяцев назад +1

      Here: ruclips.net/video/2-gFDeai8O8/видео.html

  • @TanveerHussain-gj7te
    @TanveerHussain-gj7te 3 месяца назад

    fftw3 library can't be installed
    File can't be located

  • @yayatinaresh6900
    @yayatinaresh6900 Год назад

    This does not install latest version of quantum espresso. You have to compile your self for newest version

    • @videoz4you253
      @videoz4you253 Год назад +1

      I have checked and let me confirm, this is the best qe installation. Check your facts. How do you know that it is not the latest?

  • @9443429868
    @9443429868 Год назад +1

    i installed sir but how to open it terminal
    or any shortcut

    • @theoreticalcmp
      @theoreticalcmp  Год назад

      You don't have to open it. Just run any code based on it.

    • @9443429868
      @9443429868 Год назад

      Ok sir.. can I have ur mail ID

    • @theoreticalcmp
      @theoreticalcmp  Год назад

      @@9443429868 it's thrtclcmp@gmail.com

    • @chewefwalo4646
      @chewefwalo4646 Год назад

      Use control , shift and T at once. Short cut opening the terminal.

    • @imtiazikramirfan597
      @imtiazikramirfan597 Год назад

      @@chewefwalo4646 the shortcut u taught is for openning new tab on browser

  • @muhriddinmahkamov8392
    @muhriddinmahkamov8392 Год назад

    But, How to install QE with GPU support?
    Please teach that issue in next tutorial

    • @AliBONIT-ej9jm
      @AliBONIT-ej9jm 11 месяцев назад

      you make this command ./configure --enable-openmp

  • @seramrebikadevi4828
    @seramrebikadevi4828 9 месяцев назад

    How to remove this installation again?

  • @hemantkumar7349
    @hemantkumar7349 Год назад

    Sir please start the 2nd lecture

  • @muzaffariqbalkhan334
    @muzaffariqbalkhan334 Год назад

    thank you sir

  • @mdasaduzzaman5318
    @mdasaduzzaman5318 Год назад +1

    How can I get the password?

  • @OmarBENMYA
    @OmarBENMYA 15 дней назад +1

    It request password

    • @theoreticalcmp
      @theoreticalcmp  15 дней назад

      @@OmarBENMYA sir, it's the password of your Ubuntu

    • @OmarBENMYA
      @OmarBENMYA 15 дней назад +1

      @theoreticalcmp but no character to be tapped

    • @theoreticalcmp
      @theoreticalcmp  15 дней назад +1

      @OmarBENMYA see, just type the password and then press enter. Characters or stars will not appear on the screen. But typing the password and pressing the enter will do the job.

    • @OmarBENMYA
      @OmarBENMYA 15 дней назад +1

      @theoreticalcmp thank you very much