Quantum Espresso in Windows_Easiest Installation of QE

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  • Опубликовано: 7 фев 2025

Комментарии • 58

  • @theoreticalcmp
    @theoreticalcmp  2 года назад +8

    Link for the download page:
    drive.google.com/drive/folders/1BL8922hBP0tsjTQ4b6h6HVgsgyC1iqfc?usp=sharing

  • @vipin_cyriac
    @vipin_cyriac 3 года назад +7

    Please do a tutorial for QE for Quantum calculations

  • @AbdiGalata
    @AbdiGalata 2 года назад +1

    Thank you very much! It was great. Please post for us the remaining steps.

  • @wilfredthomas4106
    @wilfredthomas4106 6 месяцев назад

    Thanks for adding the drive link. The updated download link in the QE site is a little bit confusing

  • @manoranjansethy2822
    @manoranjansethy2822 2 года назад

    your channel is very very interesting

  • @Random_videos_SB
    @Random_videos_SB 2 года назад

    So amazing sir. Thanks a ton!

  • @uzelektroniktv8567
    @uzelektroniktv8567 5 месяцев назад

    Thank you very much!

  • @atchayaraman
    @atchayaraman Месяц назад +1

    i'm getting error pop up during the calculation in burai. could you help me to resolve it?

    • @theoreticalcmp
      @theoreticalcmp  Месяц назад

      Mail me at thrtclcmp@gmail.com with the error screenshot

  • @rupeshmahore
    @rupeshmahore 3 года назад

    Dear Sir,
    Your channel is amazing. Thankyou so much.
    I have worked with classic MD/MC Simulations. I just started learning about Quantum simulations. I would like to know how we can simulate Quantum materials with atomistic simulations (other than DFT).

  • @entertainmentfanshub
    @entertainmentfanshub 2 года назад +1

    Dear Sir,
    I have installed QE as per your guidelines and reached the Final window as in this video. But I did not find any icon of QE on Desktop nor find in control panel.
    How to run QE. Please guide me.
    I look forward to hearing from you.
    Kind Regards,

    • @theoreticalcmp
      @theoreticalcmp  2 года назад +1

      Just for your request, tomorrow, we will publish our first video writing input file for quantum espresso and how to work with it.
      Btw, there qe is not a software but a fortran-based package and hence, no shortcut or icon will be there.

    • @entertainmentfanshub
      @entertainmentfanshub 2 года назад +1

      @@theoreticalcmp Thanks for your kind reply. After installation I don't find any way to run/ open it.

    • @theoreticalcmp
      @theoreticalcmp  2 года назад +1

      Just wait for our video

    • @entertainmentfanshub
      @entertainmentfanshub 2 года назад

      @@theoreticalcmp Dear Sir,
      When will you upload video?

    • @theoreticalcmp
      @theoreticalcmp  2 года назад

      @@entertainmentfanshub some sudden situations hopped in, so, it may take 15 days at least. Moving away for treatment. However, I will be active online and in the meantime, you may write to me at thrtclcmp@gmail.com.

  • @annasharma_4
    @annasharma_4 2 года назад

    Dear Sir,
    I have succesfully installed the QE, but i dont know how to go ahead to learn, kindly guide me

  • @yacinechibane-w5g
    @yacinechibane-w5g Год назад +1

    please can you help me to install qe on windows, I have started installation but I have a problems with the runing executables

    • @theoreticalcmp
      @theoreticalcmp  Год назад

      Mail me at thrtclcmp@gmail.com with required screenshots.

  • @Md.RubelHossen-r5t
    @Md.RubelHossen-r5t 2 месяца назад +1

    When I extracted I didn't find the pw.exe file. Can you please help me to install the QE?

    • @theoreticalcmp
      @theoreticalcmp  2 месяца назад

      Mail me with screenshot at thrtclcmp@gmail.com

  • @uos786
    @uos786 Год назад +1

    What is minimum Processor and Ram of computer for Quantum espresso?

    • @uos786
      @uos786 Год назад

      Sir I have to buy Computer tomorrow please tell me?

    • @theoreticalcmp
      @theoreticalcmp  Год назад

      If you are asking for minimum, 2GB of RAM and i3 will do fine for cubic structures. But , if you take really large no of atoms in your cell, then, your computational cost will increase proportionally.
      I think, if you tell me your budget, I will be able to guide better.

    • @uos786
      @uos786 Год назад

      @@theoreticalcmp I'm from Pakistan my budget is 20 thousand rupees

    • @uos786
      @uos786 Год назад

      What if I have Core i5 with 8gb ram and 2nd generation?

    • @theoreticalcmp
      @theoreticalcmp  Год назад

      @@uos786 see, best will be i7 more than 8th generation and 16 GB ram, with 8 core. With this, you will have a really good number of choices to research upon.
      If however, your budget is allowing i5 with 8gb ram, then it's good too. My only suggestion will be, take a look at cores. 8 core is better. Must not be less than 4.
      Again, if you can wait and gather some money , it's better to delay a bit and buy i7 later instead of buying i5 now.

  • @english8376
    @english8376 7 месяцев назад +1

    I have window 7 can I install quntanum espresso?

  • @nazmulhasan5915
    @nazmulhasan5915 2 года назад +1

    Hey, recently they changed their interface of download site, and am bit confused about installation. Can you please help me?

    • @theoreticalcmp
      @theoreticalcmp  2 года назад

      Dear Nazmul,
      Check this link. github.com/advancesoftcorp/espresso/releases

    • @nazmulhasan5915
      @nazmulhasan5915 2 года назад

      @@theoreticalcmp Thanks so much

  • @mohiuddin4001
    @mohiuddin4001 10 месяцев назад

    Could you please send me folder for installation of QE for windows.
    I have downloaded 7.2 v, but it has no pw.exe file.

  • @jerryli5555
    @jerryli5555 9 месяцев назад

    Thank you for making QE4Win. Could you please add EPW into the binary package? appreciated

  • @the_physicsworld
    @the_physicsworld 3 года назад

    plz continuous DFT lectures series

  • @cookwithlacy8236
    @cookwithlacy8236 2 года назад

    Sir, I want to construct fcc crystal structure of silver nanoparticles. Can you please help me with how can I do it using quantum espresso?

  • @theoreticalcmp
    @theoreticalcmp  2 года назад +2

    If you can't find the file in web, mail me.

    • @mounsifabbes5712
      @mounsifabbes5712 2 года назад +1

      I can't find the file ..give me ur email plz

    • @theoreticalcmp
      @theoreticalcmp  2 года назад

      It's thrtclcmp@gmail.com

    • @Your_Research_Buddy
      @Your_Research_Buddy 2 года назад

      @@theoreticalcmp sir how to prepare input file?

    • @santoshmohite3518
      @santoshmohite3518 2 года назад

      I can't find the files on the same website. Please Provide the link of the same files.

    • @ashirnibir8740
      @ashirnibir8740 2 года назад

      @@theoreticalcmp Sir I have sent you a mail in this regard. Please have a check.

  • @sakalsingla3042
    @sakalsingla3042 2 года назад

    Hello Sir, i am not able to download the file. Please help me

  • @alexisfaraday
    @alexisfaraday Месяц назад +1

    You can help me please

  • @mdazaharuddinahmed1794
    @mdazaharuddinahmed1794 2 года назад

    Dear Sir,
    Please make a tutorial for installing QMCPACK on Ubuntu 20.04 system.. Nowhere we get any installation tutorial for it..
    Please do it ...

  • @vz00260
    @vz00260 2 года назад

    What i do next after waiting for input?

  • @alexisfaraday
    @alexisfaraday Месяц назад +1

    Je n’ai pas pu installer le logiciel

    • @theoreticalcmp
      @theoreticalcmp  Месяц назад

      Envoyez-moi un mail à thrtclcmp@gmail.com

    • @alexisfaraday
      @alexisfaraday Месяц назад

      Je viens de vous laisser un message ..Merci