Ground state
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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 3885 days ago - 0 Replies
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Last post by pouillon
Fri Aug 09, 2013 12:56 pm
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- 6 Replies
- 3739 Views
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Last post by ssh77
Fri Jun 12, 2020 12:47 pm
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Parallelization and convergence
by erichmond » Sun Apr 19, 2020 11:48 pmThis topic was posted 1439 days ago - 18 Replies
- 9719 Views
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Last post by erichmond
Fri Jun 12, 2020 2:37 am
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Phase transition under pressure?
by new_986 » Mon May 25, 2020 12:12 pmThis topic was posted 1404 days ago - 4 Replies
- 3211 Views
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Last post by new_986
Thu Jun 11, 2020 12:13 pm
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kptopt in input for Wannier90
by resu » Wed Jun 10, 2020 10:58 amThis topic was posted 1388 days ago - 0 Replies
- 3012 Views
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Last post by resu
Wed Jun 10, 2020 10:58 am
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Non primitive cells, space groups [SOLVED]
by jerkov » Thu Jun 04, 2020 6:08 pmThis topic was posted 1394 days ago - 3 Replies
- 3673 Views
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Last post by ebousquet
Wed Jun 10, 2020 8:56 am
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- 1 Replies
- 1804 Views
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Last post by ebousquet
Thu Jun 04, 2020 4:04 pm
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- 1 Replies
- 1695 Views
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Last post by ebousquet
Thu Jun 04, 2020 3:58 pm
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U determination for oxygen monoclinic ?
by kittysoman2013 » Fri May 29, 2020 5:02 pmThis topic was posted 1400 days ago - 1 Replies
- 1730 Views
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Last post by ebousquet
Thu Jun 04, 2020 3:54 pm
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Xred for 2d Material such as MoS2, Be2C
by wei » Wed Mar 11, 2020 6:13 amThis topic was posted 1479 days ago - 3 Replies
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Last post by ebousquet
Thu Jun 04, 2020 3:19 pm
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- 0 Replies
- 3095 Views
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Last post by hameed1987
Sat May 30, 2020 7:15 am
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- 2 Replies
- 2257 Views
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Last post by suman
Wed May 27, 2020 3:43 am
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Optimization of tetragonal perovskit???
by new_986 » Mon Feb 24, 2020 11:47 amThis topic was posted 1495 days ago - 16 Replies
- 12236 Views
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Last post by ebousquet
Mon May 18, 2020 11:14 am
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DOS of Alp using the tetrahedron method
by domakani » Tue Oct 08, 2019 7:51 pmThis topic was posted 1634 days ago - 9 Replies
- 5414 Views
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Last post by erichmond
Fri May 01, 2020 4:51 am
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Calculation parallelization
by Vladyslav » Sun Mar 08, 2020 4:29 pmThis topic was posted 1482 days ago - 1 Replies
- 1700 Views
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Last post by ebousquet
Mon Apr 20, 2020 8:41 am
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Tutorial on basic parallelism
by EchoTheCat » Sat Mar 21, 2020 6:58 pmThis topic was posted 1469 days ago - 1 Replies
- 1797 Views
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Last post by ebousquet
Mon Apr 20, 2020 8:23 am
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how to generate phonon dispersion
by jane123 » Wed Mar 25, 2020 6:33 pmThis topic was posted 1465 days ago - 1 Replies
- 1650 Views
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Last post by ebousquet
Mon Apr 20, 2020 8:16 am
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Errors of NLO calculation with "anaddb < tnlo_5.files"
by cocoinsky » Sat Apr 04, 2020 4:21 pmThis topic was posted 1455 days ago - 1 Replies
- 1800 Views
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Last post by ebousquet
Mon Apr 20, 2020 8:13 am
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- 2 Replies
- 2569 Views
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Last post by hameed1987
Sun Apr 19, 2020 10:14 am
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K-resolved projection of the eigenstates
by CHILL » Wed Mar 18, 2020 4:50 pmThis topic was posted 1472 days ago - 2 Replies
- 2358 Views
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Last post by CHILL
Sat Apr 04, 2020 6:39 pm
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Input file for optimization
by hameed1987 » Sat Feb 29, 2020 6:42 amThis topic was posted 1490 days ago - 4 Replies
- 3436 Views
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Last post by ebousquet
Mon Mar 30, 2020 9:51 am
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- 0 Replies
- 2271 Views
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Last post by EchoTheCat
Sun Mar 22, 2020 5:56 am
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[CORRECTED 6.6] BoltzTrap output - prtbltztrp variable
by nikolaij » Thu Feb 24, 2011 6:25 pmThis topic was posted 4782 days ago - 6 Replies
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Last post by saikrishna
Wed Mar 18, 2020 11:25 am
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Failing to relax a 2D structure
by CHILL » Mon Jan 27, 2020 2:30 pmThis topic was posted 1523 days ago - 3 Replies
- 3021 Views
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Last post by CHILL
Tue Mar 17, 2020 1:53 pm
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Positron calculations fail with forrtl: severe (174): SIGSEGV, segmentation fault occurred
by rajaraman » Wed Mar 11, 2020 12:48 pmThis topic was posted 1479 days ago - 1 Replies
- 2024 Views
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Last post by rajaraman
Mon Mar 16, 2020 12:20 pm
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Determining xred, rprim, and shiftk
by erichmond » Wed Jan 29, 2020 2:43 amThis topic was posted 1521 days ago - 2 Replies
- 3084 Views
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Last post by erichmond
Fri Mar 13, 2020 8:11 pm
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