Search found 9 matches

by mab
Sun Jul 15, 2012 5:40 pm
Forum: Ground state
Topic: error in convergence
Replies: 2
Views: 2136

Re: error in convergence

Dear Dr Singh,

You have a serious problems in you input file. I advice to:
- organize your file structural information, kpont, Ecut, print in th last.
- Read a very nice and good abinit tutorial.

Good lunck

Mab
by mab
Wed Jul 04, 2012 11:22 pm
Forum: Ground state
Topic: Top of valence band
Replies: 0
Views: 1451

Top of valence band

Hi all,

I have a simple and serious problem : How i can find a Top of Valence Band?

Thank you

Mab
by mab
Sun Apr 08, 2012 9:41 am
Forum: Ground state
Topic: Abinit and heterojunction
Replies: 0
Views: 1439

Abinit and heterojunction

Hi all,

In the case of the heterojunction Si/Ge, I have build the supercell. My questions are:
- I can plot I(curent) vs V(voltage)?
- What are the other curves that i can plot in the case of the heterojunction?

Thousand and one times thank you.
by mab
Sat Feb 04, 2012 3:27 pm
Forum: Ground state
Topic: Problem with space group 166 (R-3m)
Replies: 2
Views: 2014

Re: Problem with space group 166 (R-3m)

It s ok, Thank you

Mab
by mab
Sun Jan 29, 2012 9:34 pm
Forum: Ground state
Topic: Problem with space group 166 (R-3m)
Replies: 2
Views: 2014

Problem with space group 166 (R-3m)

Hi Abinit users, All the time when i use this structure and this atomic positions Abinit poster an error message (look below). Thank you for your help Mab ---------------------------- natom 2 ntypat 2 znucl 8 29 typat 1 2 acell 8.0 8.0 30.0 spgroup 166 spgaxor 1 spgorig 1 brvltt 7 angdeg 90 90 120 x...
by mab
Thu Nov 17, 2011 6:01 pm
Forum: Configuring and compiling ABINIT
Topic: error when i make abinit 6.10.2
Replies: 2
Views: 2586

Re: error when i make abinit 6.10.2

Hi

This error comes probably from ./configure. You change the option after this command ./configure --option.

Good luck
by mab
Mon Nov 14, 2011 11:18 am
Forum: Configuring and compiling ABINIT
Topic: Problem to installing Abinit-10.6.1 on Opensuse 11.4
Replies: 5
Views: 5487

Re: Problem to installing Abinit-10.6.1 on Opensuse 11.4

Thank you very much but i m sorry after "sudo make install" i find : use etsf_io_low_level 1 Fatal Error: Can't open module file 'etsf_io_low_level.mod' for reading at (1): Aucun fichier ou dossier de ce type make[2]: *** [m_errors.o] Erreur 1 make[2] : on quitte le répertoire « /home/zemz...
by mab
Sun Nov 13, 2011 7:44 pm
Forum: Configuring and compiling ABINIT
Topic: Problem to installing Abinit-10.6.1 on Opensuse 11.4
Replies: 5
Views: 5487

Re: Problem to installing Abinit-10.6.1 on Opensuse 11.4

Hi, Thank you for your attention but when i do "make install" the result is: make[3] : on entre dans le répertoire « /home/zemzemi/DossierCalcul/Dossier_Abinit/abinit-6.10.1/src/98_main » test -z "/usr/local/bin" || /bin/mkdir -p "/usr/local/bin" /usr/bin/install -c abi...
by mab
Sun Nov 13, 2011 3:45 pm
Forum: Configuring and compiling ABINIT
Topic: Problem to installing Abinit-10.6.1 on Opensuse 11.4
Replies: 5
Views: 5487

Problem to installing Abinit-10.6.1 on Opensuse 11.4

Dear Abinit users, I want to install abinit-6.10.1 on Opensuse 11.4. You will find the messages after configure and install. I count on you ****************************************************************************************************************************************************************...