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- Marking answers for solved issues
by pouillon » Fri Aug 09, 2013 12:56 pm - 0 Replies
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- Last post by pouillon
Fri Aug 09, 2013 12:56 pm
- Marking answers for solved issues
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- Problem with t41.file test
by sdwang » Fri Sep 24, 2010 9:56 am - 4 Replies
- 2982 Views
- Last post by Naina
Tue Sep 27, 2016 1:29 pm
- Problem with t41.file test
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- Problem with ScaLAPACK
by sheng » Thu Sep 15, 2016 5:48 am - 0 Replies
- 924 Views
- Last post by sheng
Thu Sep 15, 2016 5:48 am
- Problem with ScaLAPACK
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- fatbands for ncpp
by xw213 » Fri Sep 09, 2016 4:49 pm - 4 Replies
- 1158 Views
- Last post by xw213
Tue Sep 13, 2016 5:21 pm
- fatbands for ncpp
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- LDA+U with U correction on p-orbitals
by nirama » Fri Jul 29, 2016 9:52 pm - 2 Replies
- 2421 Views
- Last post by sheng
Tue Sep 13, 2016 12:09 pm
- LDA+U with U correction on p-orbitals
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- fatband file and its Fermi level?
by pipidog » Mon Jun 06, 2016 7:59 am - 2 Replies
- 3543 Views
- Last post by amadon
Tue Sep 13, 2016 9:45 am
- fatband file and its Fermi level?
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- errors in nscf caculation with thousands of bands using PAW
by xw213 » Sat Sep 03, 2016 6:19 am - 2 Replies
- 1201 Views
- Last post by xw213
Mon Sep 05, 2016 7:47 pm
- errors in nscf caculation with thousands of bands using PAW
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- Creating an amorphous HfO2 supercell on ABINIT
by Mohamedy002 » Tue Aug 30, 2016 2:40 pm
- 3 Replies
- 1076 Views
- Last post by Mohamedy002
Tue Aug 30, 2016 10:21 pm
- Creating an amorphous HfO2 supercell on ABINIT
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- t2g and eg orbitals [SOLVED]
by phialberta » Fri Aug 12, 2016 7:46 pm - 2 Replies
- 1077 Views
- Last post by phialberta
Mon Aug 22, 2016 2:39 pm
- t2g and eg orbitals [SOLVED]
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- band structure using hybrid functionals
by hfarsakh » Thu Aug 11, 2016 12:34 am - 3 Replies
- 1758 Views
- Last post by torrent
Wed Aug 17, 2016 2:55 pm
- band structure using hybrid functionals
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- Running optimization and EBS in same run (different dataset)
by marco.digennaro » Fri Aug 12, 2016 5:32 pm - 0 Replies
- 718 Views
- Last post by marco.digennaro
Fri Aug 12, 2016 5:32 pm
- Running optimization and EBS in same run (different dataset)
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- Fixing the spin at each atom
by senersen » Fri Aug 05, 2016 12:10 pm - 1 Replies
- 941 Views
- Last post by ebousquet
Fri Aug 12, 2016 12:24 pm
- Fixing the spin at each atom
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- MPI_Abort error in Abinit 8.0.8 [SOLVED]
by sheng » Thu Jul 28, 2016 10:54 am
- 2 Replies
- 1604 Views
- Last post by sheng
Fri Jul 29, 2016 10:28 am
- MPI_Abort error in Abinit 8.0.8 [SOLVED]
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- Restarting from the same WFN didn't got the same energy
by Vladimir » Tue Jul 19, 2016 6:54 am
- 5 Replies
- 1813 Views
- Last post by Vladimir
Thu Jul 28, 2016 9:35 am
- Restarting from the same WFN didn't got the same energy
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- BUG: about to overwrite gbound in sphereboundary.F90
by recohen » Wed May 04, 2016 2:03 pm - 3 Replies
- 2005 Views
- Last post by gabriel.antonius
Tue Jun 21, 2016 5:06 pm
- BUG: about to overwrite gbound in sphereboundary.F90
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- VCA for the sum of the pseudopotential coefficients must 1
by onion2440 » Fri Mar 25, 2016 11:26 am - 0 Replies
- 1360 Views
- Last post by onion2440
Fri Mar 25, 2016 11:26 am
- VCA for the sum of the pseudopotential coefficients must 1
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- Possible bug: ScfConvergenceWarning
by sheng » Mon Mar 21, 2016 4:09 am - 3 Replies
- 2173 Views
- Last post by Jordan
Wed Mar 23, 2016 9:43 am
- Possible bug: ScfConvergenceWarning
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- Can Abinit perform van der Waals interactions
by Seba Darshan » Thu Mar 17, 2016 6:22 am - 0 Replies
- 1321 Views
- Last post by Seba Darshan
Thu Mar 17, 2016 6:22 am
- Can Abinit perform van der Waals interactions
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- k-resolved PDOS [SOLVED]
by PhilippBa » Wed Mar 02, 2016 5:12 pm - 1 Replies
- 1242 Views
- Last post by PhilippBa
Sun Mar 06, 2016 12:32 am
- k-resolved PDOS [SOLVED]
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- Failed to perform DATASET 2 [SOLVED]
by gh.phys » Mon Feb 15, 2016 11:03 am - 3 Replies
- 1679 Views
- Last post by gh.phys
Wed Feb 24, 2016 11:11 am
- Failed to perform DATASET 2 [SOLVED]
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- Ecut Convergence and Parallelism [SOLVED]
by Patrick » Wed Jan 13, 2016 7:01 pm - 2 Replies
- 1722 Views
- Last post by Patrick
Thu Jan 28, 2016 2:17 pm
- Ecut Convergence and Parallelism [SOLVED]
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- error messages in optimisation run.
by umasubbiah » Sun Aug 24, 2014 11:46 pm - 5 Replies
- 3669 Views
- Last post by Jordan
Tue Jan 19, 2016 3:16 pm
- error messages in optimisation run.
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- Energy calculation of an element in N-doped graphene system
by Seba Darshan » Sun Jan 10, 2016 10:08 am - 0 Replies
- 1234 Views
- Last post by Seba Darshan
Sun Jan 10, 2016 10:08 am
- Energy calculation of an element in N-doped graphene system
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- what's the meaning of the tag "newg" in the code?
by onion2440 » Mon Dec 14, 2015 2:56 am - 0 Replies
- 977 Views
- Last post by onion2440
Mon Dec 14, 2015 2:56 am
- what's the meaning of the tag "newg" in the code?
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- How to do geometry optimization with defect?
by raul_l » Mon Nov 16, 2015 2:37 pm - 1 Replies
- 1337 Views
- Last post by raul_l
Mon Nov 23, 2015 12:43 pm
- How to do geometry optimization with defect?
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- DMFT difference in Nb. of corr. elec. G_imp and G_loc
by PhilippBa » Mon Nov 09, 2015 10:53 am
- 2 Replies
- 1366 Views
- Last post by PhilippBa
Tue Nov 10, 2015 11:50 am
- DMFT difference in Nb. of corr. elec. G_imp and G_loc
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