-
“All sites listed as possible execution hosts are out of service.”
Q&A|Closed | Responses: 3
I am trying to run ABINIT, but when I go to simulate the program I get an error saying that "All sites listed as possible execution hosts are out of service". I have also tried to run...
https://nanohub.org/answers/question/1689
-
AbInit NanoHub GUI
Q&A|Closed | Responses: 1
Hello everybody,
I would like to know if the NanoHub GUI for preparing the https://nanohub.org/answers/question/846
-
abinit MPI doesnot work
Q&A|Open | Responses: 2
it seems that the abinit MPI does not work.
it says that”
abinip does not exsist “
https://nanohub.org/answers/question/111
-
As ABINIT update?
Q&A|Closed | Responses: 0
.Version 6.12.3 of ABINIT
.(MPI version, prepared for a x86_64_linux_gnu4.7 computer)
.Copyright (C) 1998-2012 ABINIT group .
ABINIT comes with ABSOLUTELY NO...
https://nanohub.org/answers/question/1631
-
Can ABINIT be used to determine the refractive index of a molecule? If yes, how to get it??
Q&A|Closed | Responses: 1
https://nanohub.org/answers/question/971
-
Can I visualize the band structure and density of states of graphene after getting the output file from ABINIT running in Linux
Q&A|Closed | Responses: 1
https://nanohub.org/answers/question/1314
-
changing electron occupation
Q&A|Closed | Responses: 1
I would like to change the electron occupation of the energy bands. I tried the command “occ”, but I couldn’t manage to get it working. Do you have any suggestions? Thanks
https://nanohub.org/answers/question/1157
-
density of states
Q&A|Closed | Responses: 0
Hi –
I tried to calculate the density of states using “prtdos” and “prtdosm”. From the Abinit manual it seems that “prtdosm” outputs the local DOS in...
https://nanohub.org/answers/question/1205
-
does Abinit support all parralalisme level?
Q&A|Closed | Responses: 1
Dear all
i would ask if the nanohub compiled abinit version support all parallalisme levels ( kpoints, band, FFT ..) because i have tried to run my work on 16 cores using paral_kgb 1 and npkbt 8...
https://nanohub.org/answers/question/1347
-
Excuse me, why abinit tool doesn’t work with “In” element?
Q&A|Closed | Responses: 2
https://nanohub.org/answers/question/955
-
GGA only psp for Ce?
Q&A|Closed | Responses: 1
Hello!
I ran the calculation with Ce and got a message:
pspatm: WARNING – Pseudopotential file pspxc= 11, not equal to input ixc= 1. These parameters must agree to get the...
https://nanohub.org/answers/question/1115
-
Hello, how we define the different zones (intergranular zone, bulk zone, zone between this two)
Q&A|Open | Responses: 1
Hello,
Please, I would like an answer to my question and sorry for this long letter:
Well, I construct a supercell of 60 atom of Zr contains two grains oriented with an angle...
https://nanohub.org/answers/question/1667
-
Hello, Is that the GGA pseudopotential of Zr is listed (existed) or not (calcul with ABINIT)?
Q&A|Open | Responses: 1
Hello, I did a calculation with ABINIT on the Zr atom but is not working, I suspect that the problem is related to pseudopotential (GGA and LDA). Help...
https://nanohub.org/answers/question/1613
-
Hi Iam unable to launch abinit tool please help me.
Q&A|Closed | Responses: 1
https://nanohub.org/answers/question/981
-
How to obtain the spin density in Fe crystal bcc?
Q&A|Open | Responses: 1
Where in my input file should I include the option nsppol=2 in order to obtain the spin density for example in Fe-crystalline? Or it is not possible yet on nanoHUB?
https://nanohub.org/answers/question/825
-
how to upload pseudopotential file (pawps)
Q&A|Closed | Responses: 1
Hello!
I want to upload a pseudopotential file (paw). Is it possible?
https://nanohub.org/answers/question/905
-
I’m running my inputs and they are still queued
Q&A|Closed | Responses: 1
I'm running my inputs and after a day they are still queued
https://nanohub.org/answers/question/1628
-
input files
Q&A|Closed | Responses: 1
Hello
I am wondering if there is a feature here allow me to use my own abinit input files?
https://nanohub.org/answers/question/793
-
input options
Q&A|Closed | Responses: 2
Hello,
Is it possible to save and recall the structural and run simulation options entering the input form of the tool?
https://nanohub.org/answers/question/896
-
Is it allowed to download abinit output files from my storages?
Q&A|Closed | Responses: 1
Hi,
Is it allowed to download abinit output files in my storage?
Regards,
Thanusit
https://nanohub.org/answers/question/1584