Thank you so much for the tutorial, can you send me the arch.make file to this email please: jrr036@alumnos.ucn.cl Greetings from the Physics Department of UCN Chile
I've tried to set upThese two programs before. but I have not succeeded. I can setup these with your help and your video. Thank you very very much. After that, may you install vasp and virtual nanolab programs and used together?
Hello. thank you so much for your great installation video. i have successfully installed and tested siesta on my pc computer, however, when i have tried to generate a pseudopotential using atom program ( after compilation of atom program), showed me theses errors. i dont know how can i solve these problems. if u know the solution please help me. thank you.
stop parameter =656 note: the following floating-point exceptions are signalling: IEEE _INVALID_FLAG IEEE_OVERFLOW_FLAG IEEE_UNDERFLOW_FLAG IEEE_DENORMAL cp: cannot stat'VPSOUT': no such file or directory cp: cannot stat'VPSFMT': no such file or directory
dear viewers, if you need any other help regarding these two or any other theoretical condensed matter physics software please let us know in the comment box. We will be happy to help you.
hi.I am a beginner and require your help in installing quantum espresso on Ubuntu. please send me the detailed installation process(with required extensions) to aarti.choppakatla@gnits.ac.in. thank you.
getting error while installing Siesta /// Fatal Error: Can't open module file ‘netcdf.mod’ for reading at (1): No such file or directory compilation terminated. arch.make:62: recipe for target 'iogrid_netcdf.o' failed make: *** [iogrid_netcdf.o] Error 1
We will be happy to help you. But We need to know the problem clearly. Please tell us your mail ID and institution name so that we can contact you. Thanks
My mail address is dubey_shubha@yahoo.in And my problem is that i am installing the wien2k_14.2 on Redhat 6.0 with MKL library 8.0 and Fortran compiler 9.0 I am unable to compile it with the higher version of fortran and mkl. Should i switch the OS??
Can you please send me the arch.make file for siesta installation, after make command it is showing error lnetcdff: no such file or directory lpthread :no such file or directory, what to do please help
Please, could you send me the installation guide to siesta software? Occurs that is a little bit difficult to see what strings I must to put at the moment of installing the dependencies. I send this message also for e-mail. Thanks for help.
I copied your arch.make file, but i keep getting the error: "Makefile:254: recipe for target 'libmpi_f90.a' failed make: *** [libmpi_f90.a] Error 2" could you help me?
Dear Malcom, it may happen that some parts of the file has been mistaken. Please send us your mail id and your institution name so that we can send you the file itself. REPLY
First of all thank you a lot sir...i have installed QE following your video but i am getting the following error while running example04...Please tell me what is the fault? ./run_example /home/anupriya/Downloads/QE/Examples/PW/example04 : starting This example shows how to calculate the polarization via Berry Phase in PbTiO3 (contributed by the Vanderbilt Group in Rutgers University). ./run_example: 17: ./run_example: .~/Downloads/QE/qe-6.1/environment_variables: not found executables directory: pseudo directory: temporary directory: checking that needed directories and files exist... ERROR: /pw.x not existent or not executable Aborting
Instead of writing ".~/Downloads/QE/qe-6.1/environment_variables:", write, ".~home/Downloads/QE/qe-6.1/environment_variables:" and change the paths for pseudo and temporary diectory in the similar way and let us know. Hope it should work.
As you said ..i have changed the path in 'run_example' file and the paths for pseudo and temporary directory in 'environment_variables' file also... but it is showing the same error..
Dear Tulsi Kumar, there is no separate installation file for QE like SIESTA. Mail your input file, error shown screenshot, and the other details to thrtclcmp@gmail.com. May we ask where are you from so that if nearby, you can take personal help too. please subscribe to our channel for free.
![Installing Quantum ESPRESSO on Linux-UBUNTU for Parallel Execution [TUTORIAL]](http://i.ytimg.com/vi/2PAJGrNhZB8/mqdefault.jpg)
![Installing Quantum ESPRESSO on Linux-UBUNTU for Parallel Execution [TUTORIAL]](/img/tr.png)
Thank you so much for the tutorial, can you send me the arch.make file to this email please: jrr036@alumnos.ucn.cl
Greetings from the Physics Department of UCN Chile
It's an honour. I already have sent you the file in that mail. Wish your department prosperity.
Thank you so much finally i successfully installed siesta... thanks a ton.
We will be thr if you face any othr problm. Let us know what you need
Great video, I think you should make one showing how to prepare and input file to QE. I'm interested in NMR Calculations
Is the installation process is same for siesta 4.1 b2 version?
And does this package contain xmgrace xcrysden and all?
See, currently I've adopted VASP. You better check the manual..
i installed siesta in serial mode and i wanted to change in parallel mode how i can do
I've tried to set upThese two programs before. but I have not succeeded. I can setup these with your help and your video.
Thank you very very much.
After that, may you install vasp and virtual nanolab programs and used together?
We need some conversations. Let us contact through mail.
Hi, please provide minimum hardware requirement for installing quantum espresso. Thanks
Hello. thank you so much for your great installation video. i have successfully installed and tested siesta on my pc computer, however,
when i have tried to generate a pseudopotential using atom program ( after compilation of atom program), showed me theses errors. i dont know how can i solve these problems. if u know the solution please help me. thank you.
stop parameter =656
note: the following floating-point exceptions are signalling: IEEE _INVALID_FLAG IEEE_OVERFLOW_FLAG IEEE_UNDERFLOW_FLAG IEEE_DENORMAL
cp: cannot stat'VPSOUT': no such file or directory
cp: cannot stat'VPSFMT': no such file or directory
which one is the best " QE or ORCA" please ?
It depends on your system.. check our video for orca
dear viewers, if you need any other help regarding these two or any other theoretical condensed matter physics software please let us know in the comment box. We will be happy to help you.
can you send arch.make file at sampath70@gmail.com . Thanks
Definitely, we will. Since it's academic, please provide your institution name.
Hope you hv got the file and installed it successfully .
hi.I am a beginner and require your help in installing quantum espresso on Ubuntu. please send me the detailed installation process(with required extensions) to aarti.choppakatla@gnits.ac.in. thank you.
sir please send fdf file of Mos2 or tell me from where it can got
can you please tell me how the dos file , pdos and band.dat file are made
getting error while installing Siesta
///
Fatal Error: Can't open module file ‘netcdf.mod’ for reading at (1): No such file or directory
compilation terminated.
arch.make:62: recipe for target 'iogrid_netcdf.o' failed
make: *** [iogrid_netcdf.o] Error 1
Hello
I have some problem in Wien2k installation. Please could you help me in this regard?
We will be happy to help you. But We need to know the problem clearly. Please tell us your mail ID and institution name so that we can contact you. Thanks
My mail address is dubey_shubha@yahoo.in
And my problem is that i am installing the wien2k_14.2 on Redhat 6.0 with MKL library 8.0 and Fortran compiler 9.0
I am unable to compile it with the higher version of fortran and mkl.
Should i switch the OS??
Our research commitee will contact you soon
Can you please send me the arch.make file for siesta installation, after make command it is showing error lnetcdff: no such file or directory
lpthread :no such file or directory, what to do please help
Please, could you send me the installation guide to siesta software?
Occurs that is a little bit difficult to see what strings I must to put at the moment of installing the dependencies. I send this message also for e-mail.
Thanks for help.
I copied your arch.make file, but i keep getting the error:
"Makefile:254: recipe for target 'libmpi_f90.a' failed
make: *** [libmpi_f90.a] Error 2"
could you help me?
Dear Malcom, it may happen that some parts of the file has been mistaken. Please send us your mail id and your institution name so that we can send you the file itself.
REPLY
i actually got it to work!
thank you, though!!
great!! go ahead
this video is not clear, please fix this issue, I am having trouble in installing Siesta 4.0.1
Hello
does any one tell me how to compile siesta
parallely?
First of all thank you a lot sir...i have installed QE following your video but i am getting the following error while running example04...Please tell me what is the fault?
./run_example
/home/anupriya/Downloads/QE/Examples/PW/example04 : starting
This example shows how to calculate the polarization via Berry Phase
in PbTiO3 (contributed by the Vanderbilt Group in Rutgers University).
./run_example: 17: ./run_example: .~/Downloads/QE/qe-6.1/environment_variables: not found
executables directory:
pseudo directory:
temporary directory:
checking that needed directories and files exist...
ERROR: /pw.x not existent or not executable
Aborting
Instead of writing ".~/Downloads/QE/qe-6.1/environment_variables:", write, ".~home/Downloads/QE/qe-6.1/environment_variables:" and change the paths for pseudo and temporary diectory in the similar way and let us know. Hope it should work.
As you said ..i have changed the path in 'run_example' file and the paths for pseudo and temporary directory in 'environment_variables' file also... but it is showing the same error..
Please send us the file in the following mail, thrtclcmp@gmail.com. We will correct it and send you back.
hello I m from algeria please I need the copy of WORD , can you send me the installation file of siesta .
Dear Karima Bouguerra, we will definitely send you the file. What is your mail id and what is your institution nane?
bouguerrakarima76@gmail.com I m from Algeria University of bejaia.thanks.
Dear Karima Bouguerra, We already have sent you the arch.make file. Please check your mailbox. Thank you.
respected sir i am unable to install QE , please give me the installation file
Dear Tulsi Kumar, there is no separate installation file for QE like SIESTA. Mail your input file, error shown screenshot, and the other details to thrtclcmp@gmail.com. May we ask where are you from so that if nearby, you can take personal help too. please subscribe to our channel for free.
thank you very much please can you send me the arch.make file
Hi i am phd student at kota university
We have sent you the file. Please subscribe to our channel for further help & discussion
Theoretical Condensed Matter Physics hi sorry i mistakenly mention wrong emailid 😢. KINDLY SEND on psatinternet@gmail.com
It's okay. Check your mailbox now. Plz Subscribe
installation file please
olá voce pode me mandar o arquivo arch.make?
blanco.sjc@gmail.com
mas estou instalando o siesta-4.0.2