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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

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

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SCF cycle is not starting

Last post by ssh77 « Fri Jun 12, 2020 12:47 pm
Replies: 6
by ssh77 » Wed Jun 03, 2020 4:07 pm
This topic was posted 1570 days ago

6 Replies

4377 Views

Last post by ssh77
Fri Jun 12, 2020 12:47 pm
Parallelization and convergence

Last post by erichmond « Fri Jun 12, 2020 2:37 am
Replies: 18
by erichmond » Sun Apr 19, 2020 11:48 pm
This topic was posted 1615 days ago

18 Replies

13123 Views

Last post by erichmond
Fri Jun 12, 2020 2:37 am
Phase transition under pressure?

Last post by new_986 « Thu Jun 11, 2020 12:13 pm
Replies: 4
by new_986 » Mon May 25, 2020 12:12 pm
This topic was posted 1579 days ago

4 Replies

3809 Views

Last post by new_986
Thu Jun 11, 2020 12:13 pm
kptopt in input for Wannier90

Last post by resu « Wed Jun 10, 2020 10:58 am

by resu » Wed Jun 10, 2020 10:58 am
This topic was posted 1563 days ago

0 Replies

3353 Views

Last post by resu
Wed Jun 10, 2020 10:58 am
Non primitive cells, space groups [SOLVED]

Last post by ebousquet « Wed Jun 10, 2020 8:56 am
Replies: 3
by jerkov » Thu Jun 04, 2020 6:08 pm
This topic was posted 1569 days ago

3 Replies

4575 Views

Last post by ebousquet
Wed Jun 10, 2020 8:56 am
ipcel issue

Last post by ebousquet « Thu Jun 04, 2020 4:04 pm
Replies: 1
by kittysoman2013 » Sat May 23, 2020 10:37 am
This topic was posted 1581 days ago

1 Replies

2047 Views

Last post by ebousquet
Thu Jun 04, 2020 4:04 pm
Input file contents

Last post by ebousquet « Thu Jun 04, 2020 3:58 pm
Replies: 1
by ssh77 » Thu May 28, 2020 2:13 pm
This topic was posted 1576 days ago

1 Replies

1901 Views

Last post by ebousquet
Thu Jun 04, 2020 3:58 pm
U determination for oxygen monoclinic ?

Last post by ebousquet « Thu Jun 04, 2020 3:54 pm
Replies: 1
by kittysoman2013 » Fri May 29, 2020 5:02 pm
This topic was posted 1575 days ago

1 Replies

1955 Views

Last post by ebousquet
Thu Jun 04, 2020 3:54 pm
Xred for 2d Material such as MoS2, Be2C

Last post by ebousquet « Thu Jun 04, 2020 3:19 pm
Replies: 3
by wei » Wed Mar 11, 2020 6:13 am
This topic was posted 1654 days ago

3 Replies

3095 Views

Last post by ebousquet
Thu Jun 04, 2020 3:19 pm
optical properties

Last post by hameed1987 « Sat May 30, 2020 7:15 am

by hameed1987 » Sat May 30, 2020 7:15 am
This topic was posted 1574 days ago

0 Replies

3452 Views

Last post by hameed1987
Sat May 30, 2020 7:15 am
polarization in In2Se3

Last post by suman « Wed May 27, 2020 3:43 am
Replies: 2
by suman » Fri May 22, 2020 4:32 am
This topic was posted 1582 days ago

2 Replies

2688 Views

Last post by suman
Wed May 27, 2020 3:43 am
Optimization of tetragonal perovskit???

Last post by ebousquet « Mon May 18, 2020 11:14 am
Replies: 16
by new_986 » Mon Feb 24, 2020 11:47 am
This topic was posted 1670 days ago

16 Replies

15463 Views

Last post by ebousquet
Mon May 18, 2020 11:14 am
DOS of Alp using the tetrahedron method

Last post by erichmond « Fri May 01, 2020 4:51 am
Replies: 9
by domakani » Tue Oct 08, 2019 7:51 pm
This topic was posted 1809 days ago

9 Replies

6869 Views

Last post by erichmond
Fri May 01, 2020 4:51 am
Calculation parallelization

Last post by ebousquet « Mon Apr 20, 2020 8:41 am
Replies: 1
by Vladyslav » Sun Mar 08, 2020 4:29 pm
This topic was posted 1657 days ago

1 Replies

1899 Views

Last post by ebousquet
Mon Apr 20, 2020 8:41 am
Tutorial on basic parallelism

Last post by ebousquet « Mon Apr 20, 2020 8:23 am
Replies: 1
by EchoTheCat » Sat Mar 21, 2020 6:58 pm
This topic was posted 1644 days ago

1 Replies

2038 Views

Last post by ebousquet
Mon Apr 20, 2020 8:23 am
how to generate phonon dispersion

Last post by ebousquet « Mon Apr 20, 2020 8:16 am
Replies: 1
by jane123 » Wed Mar 25, 2020 6:33 pm
This topic was posted 1640 days ago

1 Replies

1848 Views

Last post by ebousquet
Mon Apr 20, 2020 8:16 am
Errors of NLO calculation with "anaddb < tnlo_5.files"

Last post by ebousquet « Mon Apr 20, 2020 8:13 am
Replies: 1
by cocoinsky » Sat Apr 04, 2020 4:21 pm
This topic was posted 1630 days ago

1 Replies

2040 Views

Last post by ebousquet
Mon Apr 20, 2020 8:13 am
DOS

Last post by hameed1987 « Sun Apr 19, 2020 10:14 am
Replies: 2
by hameed1987 » Thu Apr 09, 2020 8:43 am
This topic was posted 1625 days ago

2 Replies

3026 Views

Last post by hameed1987
Sun Apr 19, 2020 10:14 am
K-resolved projection of the eigenstates

Last post by CHILL « Sat Apr 04, 2020 6:39 pm
Replies: 2
by CHILL » Wed Mar 18, 2020 4:50 pm
This topic was posted 1647 days ago

2 Replies

2751 Views

Last post by CHILL
Sat Apr 04, 2020 6:39 pm
Input file for optimization

Last post by ebousquet « Mon Mar 30, 2020 9:51 am
Replies: 4
by hameed1987 » Sat Feb 29, 2020 6:42 am
This topic was posted 1665 days ago

4 Replies

4033 Views

Last post by ebousquet
Mon Mar 30, 2020 9:51 am
String method tutorial

Last post by EchoTheCat « Sun Mar 22, 2020 5:56 am

by EchoTheCat » Sun Mar 22, 2020 5:56 am
This topic was posted 1643 days ago

0 Replies

2561 Views

Last post by EchoTheCat
Sun Mar 22, 2020 5:56 am
[CORRECTED 6.6] BoltzTrap output - prtbltztrp variable

Last post by saikrishna « Wed Mar 18, 2020 11:25 am
Replies: 6
by nikolaij » Thu Feb 24, 2011 6:25 pm
This topic was posted 4957 days ago

6 Replies

7276 Views

Last post by saikrishna
Wed Mar 18, 2020 11:25 am
Failing to relax a 2D structure

Last post by CHILL « Tue Mar 17, 2020 1:53 pm
Replies: 3
by CHILL » Mon Jan 27, 2020 2:30 pm
This topic was posted 1698 days ago

3 Replies

3495 Views

Last post by CHILL
Tue Mar 17, 2020 1:53 pm
Positron calculations fail with forrtl: severe (174): SIGSEGV, segmentation fault occurred

Last post by rajaraman « Mon Mar 16, 2020 12:20 pm
Replies: 1
by rajaraman » Wed Mar 11, 2020 12:48 pm
This topic was posted 1654 days ago

1 Replies

2247 Views

Last post by rajaraman
Mon Mar 16, 2020 12:20 pm
Determining xred, rprim, and shiftk

Last post by erichmond « Fri Mar 13, 2020 8:11 pm
Replies: 2
by erichmond » Wed Jan 29, 2020 2:43 am
This topic was posted 1696 days ago

2 Replies

3766 Views

Last post by erichmond
Fri Mar 13, 2020 8:11 pm

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