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Marking answers for solved issues
by pouillon » Fri Aug 09, 2013 12:56 pm » in Configuring and compiling ABINITThis topic was posted 4061 days ago - 0 Replies
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Last post by pouillon
Fri Aug 09, 2013 12:56 pm
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- 3 Replies
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Last post by charlesdarnay
Fri Apr 17, 2015 7:02 pm
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No Hist or other related files in MD calculation
by pipidog » Wed Apr 15, 2015 1:19 amThis topic was posted 3447 days ago - 1 Replies
- 2368 Views
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Last post by Jordan
Thu Apr 16, 2015 9:06 am
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Very bad optimization output
by shamkhali » Wed Apr 15, 2015 7:25 amThis topic was posted 3447 days ago - 0 Replies
- 1962 Views
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Last post by shamkhali
Wed Apr 15, 2015 7:25 am
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- 1 Replies
- 2415 Views
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Last post by 8BitTRex
Sat Apr 11, 2015 8:25 pm
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- 0 Replies
- 1584 Views
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Last post by fabanias
Sat Apr 04, 2015 1:26 pm
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Optimization of unit cell under stress.
by sunnyone » Tue Jun 11, 2013 2:06 pmThis topic was posted 4120 days ago - 3 Replies
- 4024 Views
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Last post by ilukacevic
Mon Mar 23, 2015 8:43 am
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- 3 Replies
- 3431 Views
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Last post by Jordan
Wed Mar 18, 2015 9:57 am
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- 3 Replies
- 5757 Views
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Last post by JEJohns
Wed Mar 04, 2015 11:11 pm
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npwtot=npw1 BUG while reading WFK
by nnikola » Tue Feb 24, 2015 8:48 amThis topic was posted 3497 days ago - 0 Replies
- 1820 Views
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Last post by nnikola
Tue Feb 24, 2015 8:48 am
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BUG in MPI version of prtdos=3 in spin-polarized PAW
by Apophis » Wed Jul 30, 2014 8:08 pmThis topic was posted 3705 days ago - 1 Replies
- 2539 Views
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Last post by bmatt
Fri Feb 20, 2015 5:52 pm
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Primitive cell and space group?? [SOLVED]
by Nassim » Wed Feb 11, 2015 3:38 pmThis topic was posted 3510 days ago - 1 Replies
- 3094 Views
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Last post by Jordan
Wed Feb 18, 2015 10:47 am
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optcell just film cell keeping substrate fixed
by starguan » Tue Feb 17, 2015 1:59 pmThis topic was posted 3504 days ago - 0 Replies
- 1673 Views
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Last post by starguan
Tue Feb 17, 2015 1:59 pm
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ERROR in elastic constant calculation
by firstime » Tue Feb 10, 2015 4:52 pmThis topic was posted 3511 days ago - 1 Replies
- 2114 Views
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Last post by firstime
Wed Feb 11, 2015 2:08 pm
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parameters for optimization
by firstime » Sun Feb 01, 2015 11:53 amThis topic was posted 3520 days ago - 1 Replies
- 2242 Views
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Last post by ilukacevic
Mon Feb 02, 2015 9:20 am
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spgroup parameter error
by saurinrawal » Fri Jan 30, 2015 8:02 pmThis topic was posted 3521 days ago - 0 Replies
- 1743 Views
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Last post by saurinrawal
Fri Jan 30, 2015 8:02 pm
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Missing HIST file for PIMD [SOLVED]
by vahid » Mon Oct 27, 2014 1:02 pmThis topic was posted 3617 days ago - 4 Replies
- 6006 Views
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Last post by gregory
Fri Jan 30, 2015 4:17 pm
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- 1 Replies
- 2095 Views
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Last post by ilukacevic
Fri Jan 30, 2015 8:54 am
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- 0 Replies
- 1618 Views
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Last post by nayoung
Thu Jan 29, 2015 2:22 pm
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strange error in relaxation
by Wafa Maftuhin » Wed Jan 28, 2015 4:47 amThis topic was posted 3524 days ago - 0 Replies
- 1682 Views
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Last post by Wafa Maftuhin
Wed Jan 28, 2015 4:47 am
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- 1 Replies
- 3505 Views
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Last post by pouillon
Thu Jan 22, 2015 5:43 pm
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Isotope substituted crystals
by Klanker » Wed Nov 05, 2014 5:30 amThis topic was posted 3608 days ago - 1 Replies
- 2101 Views
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Last post by thomaskbrent
Wed Jan 21, 2015 7:05 am
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optimal lattice parameter GaAs
by temok » Fri May 04, 2012 8:41 amThis topic was posted 4523 days ago - 4 Replies
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Last post by the_doctor
Tue Jan 20, 2015 4:08 pm
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Non-scf PAW calculation cannot converge.
by sheng » Thu Dec 18, 2014 2:10 pmThis topic was posted 3565 days ago - 8 Replies
- 5673 Views
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Last post by sheng
Sat Jan 10, 2015 8:59 am
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Optimization of Atomic positions of GRAPHENE
by Seba Darshan » Wed Jan 07, 2015 12:50 pmThis topic was posted 3545 days ago - 0 Replies
- 1797 Views
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Last post by Seba Darshan
Wed Jan 07, 2015 12:50 pm
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Band structure of graphene supercell
by Seba Darshan » Thu Aug 28, 2014 8:57 amThis topic was posted 3677 days ago - 1 Replies
- 2586 Views
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Last post by lvmui
Fri Dec 12, 2014 6:08 am
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