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All Categories (1-20 of 20)

1. Error in ABINIT program

   Q&A|Closed | Responses: 3

   I tried to input ethanol into the simulation using a PDB file, however
   the simulation failed. I attached the error message below in the hopes
   that you might be able to know what to...

   https://nanohub.org/answers/question/2265

2. why an error of “more than 132 columns are used”? I have checked, it is less than 132

   Q&A|Closed | Responses: 0

   https://nanohub.org/answers/question/1726

3. “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

4. 

   Rodrigo Castillo

   https://nanohub.org/members/124185

5. Resources for Materials Science and Engineering

   Wiki

   Ab initio electronic structure simulation tools ABINIT :ABINIT is a package whose main program allows to find the total energy, charge density and electronic structure of systems made...

   https://nanohub.org/wiki/MaterialScienceSimulationTools

6. 

   khaan code

   I am phd student. I am from Mongolia. I want to work on abinit well. I am learning abinit.

   https://nanohub.org/members/68861

7. 

   Nicolas Torres

   https://nanohub.org/members/68656

8. Is there an ABINIT tutorial for ferromagnetic materials?

   Q&A|Closed | Responses: 2

   Suppose that we have a lattice of which we want to examine ferromagnetic properties. Can abinit help? If so, how?

   https://nanohub.org/answers/question/1015

9. I can’t get ABINIT to start on nanoHub, and can’t get the Users Guide to work either.

   Q&A|Closed | Responses: 1

   https://nanohub.org/answers/question/982

10. 

    sergey yu shishkov

    Moscow FIZ-TECH Institute 1980-1986 (MIPT ), then Kurchatov Institute of Atomic Energy, Moscow

    https://nanohub.org/members/55661

11. 

    D Ray Johnson

    Retired from ORNL Materials Science and Technology Division after 37 years.

    https://nanohub.org/members/54782

12. Error running abinit test file

    Q&A|Closed | Responses: 0

    Hello, I was running an abinit test file t46.in at the nanohub, but it has problem launching. It is a test file for generating STM charge density images for aluminium. The input is as...

    https://nanohub.org/answers/question/763

13. Get problem lauching job: can’t use non-numeric string as an operand of “-”

    Q&A|Closed | Responses: 0

    Hello, I upload a input file in abint, nanohub.org/tools/abinit/session/353309. When I run this...

    https://nanohub.org/answers/question/695

14. Could I use the abinit package on nanohub to simulate doped CNTs?

    Q&A|Closed | Responses: 0

    Hello, I am a researcher interested in performing research in computational nanotechnology and I am a new user of the nanohub website. My interest is in doped Carbon nanotube and in studying...

    https://nanohub.org/answers/question/431

15. Is there a gui for the output of abinit for plotting DOS and BANDS?

    Q&A|Closed | Responses: 0

    https://nanohub.org/answers/question/395

16. the simulation in abinit is showing errors..

    Q&A|Closed | Responses: 1

    on giving the inputs to abinit, the job runs but it gives an output showing:

    problem launching job

    can’t use non-numeric string as an operand of “-” while...

    https://nanohub.org/answers/question/337

17. ABINIT: First-Time User Guide

    Teaching Materials | 09 Jun 2009 | Contributor(s):: Benjamin P Haley

    This first-time user guide provides an introduction to using ABINIT on nanoHUB. We include a very brief summary of Density Functional Theory along with a tour of the Rappture interface. We discuss the default simulation (what happens if you don't change any inputs, and just hit...

18. abinit problem for large atoms

    Q&A|Open | Responses: 1

    while working in abinit with copper molecules I face an error like “SIZE OF YOUR INPUT FILE IS SUCH THAT INTERNAL CHARACTER STRING THAT SHOULD CONTAIN IT IS TOO SMALL” Does anyone...

    https://nanohub.org/answers/question/231

19. abinit problem

    Q&A|Open | Responses: 1

    How to resolve getting an error “line 16 has more than 132 columns”?

    https://nanohub.org/answers/question/216

20. ABINIT

    Tools | 13 May 2004 | Contributor(s):: Amritanshu Palaria, Xufeng Wang, Benjamin P Haley, Matteo Mannino, Gerhard Klimeck

    Run the community code ABINIT for electronic structure calculations under density functional theory through a convenient graphical user interface