Ground state

Moderator: bguster

Locked

1353 topics

Page 52 of 55
- Jump to page:
Previous
1
…
50
51
52
53
54
55
Next

Announcements

Replies

Views

Last post

Marking answers for solved issues

Last post by pouillon « Fri Aug 09, 2013 12:56 pm
Posted in Configuring and compiling ABINIT

by pouillon » Fri Aug 09, 2013 12:56 pm » in Configuring and compiling ABINIT
This topic was posted 4060 days ago

0 Replies

126871 Views

Last post by pouillon
Fri Aug 09, 2013 12:56 pm

Topics

Replies

Views

Last post

Convergence stops due to NaN after 20 Broyden steps

Last post by Robin « Sat Jun 12, 2010 1:14 pm
Replies: 3
by marcs » Thu Apr 29, 2010 9:59 am
This topic was posted 5258 days ago

3 Replies

4125 Views

Last post by Robin
Sat Jun 12, 2010 1:14 pm
Suitable value of ntime parameter setting calculation

Last post by dcaliste « Tue Jun 08, 2010 12:38 pm
Replies: 1
by bifern » Tue Jun 08, 2010 9:19 am
This topic was posted 5218 days ago

1 Replies

2784 Views

Last post by dcaliste
Tue Jun 08, 2010 12:38 pm
error in reading in a _DEN file from previous run

Last post by mohua « Tue Jun 08, 2010 12:47 am

by mohua » Tue Jun 08, 2010 12:47 am
This topic was posted 5219 days ago

0 Replies

2546 Views

Last post by mohua
Tue Jun 08, 2010 12:47 am
Auto-generate k-point grids containing gamma

Last post by gonze « Sun Jun 06, 2010 8:55 pm
Replies: 1
by Martin » Sun Jun 06, 2010 5:29 pm
This topic was posted 5220 days ago

1 Replies

2669 Views

Last post by gonze
Sun Jun 06, 2010 8:55 pm
mpi-io output for large files

Last post by mverstra « Thu Jun 03, 2010 12:10 am
Replies: 6
by mverstra » Wed May 26, 2010 2:08 pm
This topic was posted 5231 days ago

6 Replies

6282 Views

Last post by mverstra
Thu Jun 03, 2010 12:10 am
Quantum stress tensor and one-electron density matrix

Last post by srk « Tue Jun 01, 2010 11:52 am
Replies: 2
by srk » Wed May 19, 2010 3:54 am
This topic was posted 5238 days ago

2 Replies

3142 Views

Last post by srk
Tue Jun 01, 2010 11:52 am
mpi i/o for large WF files

Last post by anurag « Tue Jun 01, 2010 1:48 am

by anurag » Tue Jun 01, 2010 1:48 am
This topic was posted 5226 days ago

0 Replies

2794 Views

Last post by anurag
Tue Jun 01, 2010 1:48 am
How to built Band Structure Maker

Last post by Mutta « Mon May 31, 2010 9:12 am

by Mutta » Mon May 31, 2010 9:12 am
This topic was posted 5226 days ago

0 Replies

2620 Views

Last post by Mutta
Mon May 31, 2010 9:12 am
band structure job crashes

Last post by mohua « Thu May 27, 2010 7:27 pm

by mohua » Thu May 27, 2010 7:27 pm
This topic was posted 5230 days ago

0 Replies

2408 Views

Last post by mohua
Thu May 27, 2010 7:27 pm
paral_kgb crash on 130 processors

Last post by asorini « Thu May 27, 2010 12:32 am

by asorini » Thu May 27, 2010 12:32 am
This topic was posted 5231 days ago

0 Replies

2349 Views

Last post by asorini
Thu May 27, 2010 12:32 am
E vs k band structure

Last post by mohua « Wed May 26, 2010 7:41 pm
Replies: 3
by mohua » Sun May 23, 2010 12:12 am
This topic was posted 5235 days ago

3 Replies

3292 Views

Last post by mohua
Wed May 26, 2010 7:41 pm
big size optimization

Last post by jiangx3 « Wed May 26, 2010 3:34 pm
Replies: 1
by jiangx3 » Wed May 26, 2010 3:31 pm
This topic was posted 5231 days ago

1 Replies

2100 Views

Last post by jiangx3
Wed May 26, 2010 3:34 pm
wrong istwfk value read

Last post by mverstra « Wed May 26, 2010 9:45 am
Replies: 1
by Xenophon » Wed May 26, 2010 9:40 am
This topic was posted 5231 days ago

1 Replies

2449 Views

Last post by mverstra
Wed May 26, 2010 9:45 am
combined use of ionmov/optcell

Last post by mverstra « Tue May 25, 2010 10:12 am
Replies: 1
by payam » Tue May 25, 2010 4:45 am
This topic was posted 5232 days ago

1 Replies

2571 Views

Last post by mverstra
Tue May 25, 2010 10:12 am
Phonon calculations and pseudopotentials

Last post by payam « Tue May 25, 2010 4:50 am

by payam » Tue May 25, 2010 4:50 am
This topic was posted 5232 days ago

0 Replies

2086 Views

Last post by payam
Tue May 25, 2010 4:50 am
acell/xred in WFK file after relaxation run

Last post by gonze « Sun May 23, 2010 7:32 pm
Replies: 2
by mverstra » Sun May 23, 2010 4:12 pm
This topic was posted 5234 days ago

2 Replies

3127 Views

Last post by gonze
Sun May 23, 2010 7:32 pm
Density loses one atom?

Last post by SteveZ « Sat May 22, 2010 4:23 am
Replies: 2
by SteveZ » Fri May 14, 2010 9:35 pm
This topic was posted 5243 days ago

2 Replies

2678 Views

Last post by SteveZ
Sat May 22, 2010 4:23 am
E-Field Calculations

Last post by Mamikon Gulian « Fri May 21, 2010 7:28 pm
Replies: 2
by Mamikon Gulian » Thu May 20, 2010 8:21 am
This topic was posted 5237 days ago

2 Replies

3067 Views

Last post by Mamikon Gulian
Fri May 21, 2010 7:28 pm
How to access the mailing list posts ?

Last post by sonu « Thu May 20, 2010 12:08 pm
Replies: 2
by sonu » Thu May 20, 2010 11:01 am
This topic was posted 5237 days ago

2 Replies

2643 Views

Last post by sonu
Thu May 20, 2010 12:08 pm
constraints for dihedral angle

Last post by mverstra « Wed May 19, 2010 10:50 pm
Replies: 2
by vranjan » Wed May 19, 2010 4:12 pm
This topic was posted 5238 days ago

2 Replies

3775 Views

Last post by mverstra
Wed May 19, 2010 10:50 pm
DOS range

Last post by mverstra « Tue May 18, 2010 9:48 pm
Replies: 1
by Benamrani » Tue May 18, 2010 3:49 pm
This topic was posted 5239 days ago

1 Replies

2472 Views

Last post by mverstra
Tue May 18, 2010 9:48 pm
Input file for optic

Last post by yaser « Sun May 16, 2010 5:05 pm

by yaser » Sun May 16, 2010 5:05 pm
This topic was posted 5241 days ago

0 Replies

2399 Views

Last post by yaser
Sun May 16, 2010 5:05 pm
splitting of e_xc into e_x and e_c

Last post by mverstra « Sun May 16, 2010 2:40 pm
Replies: 1
by glen » Thu May 13, 2010 10:49 pm
This topic was posted 5244 days ago

1 Replies

2193 Views

Last post by mverstra
Sun May 16, 2010 2:40 pm
ecut

Last post by mverstra « Sun May 16, 2010 1:34 am
Replies: 1
by sevket simsek » Tue May 11, 2010 1:33 pm
This topic was posted 5246 days ago

1 Replies

2548 Views

Last post by mverstra
Sun May 16, 2010 1:34 am
[BUG FIXED] Structural Optimization of FCC Ag using FHI PP

Last post by mverstra « Sun May 16, 2010 12:40 am
Replies: 9
by JEJohns » Sun May 02, 2010 5:48 pm
This topic was posted 5255 days ago

9 Replies

8845 Views

Last post by mverstra
Sun May 16, 2010 12:40 am

Locked

1353 topics

Page 52 of 55
- Jump to page:
Previous
1
…
50
51
52
53
54
55
Next

Return to Board Index

Forum permissions

You cannot post new topics in this forum
You cannot reply to topics in this forum
You cannot edit your posts in this forum
You cannot delete your posts in this forum
You cannot post attachments in this forum