Thank you Dr Hiren. i am trying to do Phonon spectrum, but always getting -------- Cholesky error---- at some points of calculation after trying different options. do you have any tips which are to be taken care
Thanks for your great tutorial. But I have a problem when saving input file, it saved as RTF format. So, in cd the system cannot find the file specified.
D:\QUANTAM EX LAB>pw < graphite.in > graphite.out 'pw' is not recognized as an internal or external command, operable program or batch file. sir have an error while i run the command then this objection was raised, so please help?
1. are you using windows? if yes then you can run with pw and for linux type pw.x instead 2. if you are using windows then you have to set PATH in system environment. please watch video LAB 1 ruclips.net/video/K2eAHGxCsEg/видео.html
Thanks for inspiring me through your youtube channel of how to learning QE for beginner. Sir, could you share me your email address? I am going to send my output file for double-checking. Because I have a problem with output file when I followed the instruction in this video (Lab 3.1) Sir. Thank you!
![Bulk Modulus and Equation of State Calculation using Quantum ESPRESSO and CrysX [TUTORIAL]](/img/1.gif)
Very informative tutorial on scf calculation by making scf input file.
Great ... sir
Keep watching
Thank you Sir 😊 very informative tutorial.
Most welcome
sir, thanks for your contents.
I was wondering if there is any difference between pw and pw.x when you run the calculation.
Sir for graphene there's lots of pseudo potential files but why u choose the particular that fine. Can u explain what is the difference
because its use less computing time. you can choose by method and your convenient.
Thank you Dr Hiren.
i am trying to do Phonon spectrum, but always getting -------- Cholesky error---- at some points of calculation after trying different options. do you have any tips which are to be taken care
You can contact me!
Thanks for your great tutorial. But I have a problem when saving input file, it saved as RTF format. So, in cd the system cannot find the file specified.
choose save as option
How to correct 'pw' is not recognised as an internal or external command, operable program or batch file
set PATH in system environment. ruclips.net/video/K2eAHGxCsEg/видео.html
thank you very imprtant this tutorial
You are most welcome
Sir is there any another method for choosing CELL_PARAMETERS {alat}
yes from cif file
please attach all input file as an sample with all video also all links you have been using
I have added to other videos. thanks
im very happy,
D:\QUANTAM EX LAB>pw < graphite.in > graphite.out
'pw' is not recognized as an internal or external command,
operable program or batch file.
sir have an error while i run the command then this objection was raised, so please help?
1. are you using windows? if yes then you can run with pw and for linux type pw.x instead
2. if you are using windows then you have to set PATH in system environment. please watch video LAB 1 ruclips.net/video/K2eAHGxCsEg/видео.html
@@HIRENP yes i use the windows, but i did the same proceedure that given in your lab1 tutorial but again this error came..
Please guide
@@muhammadumair9214 hello sir, did you solve your problem facing? I am also facing the same problem.
Sir i am getting error
which error
@@HIRENP solved sir
Thanks for inspiring me through your youtube channel of how to learning QE for beginner. Sir, could you share me your email address? I am going to send my output file for double-checking. Because I have a problem with output file when I followed the instruction in this video (Lab 3.1) Sir. Thank you!
iharry03@gmail.com