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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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Pseudopotential for ions

Last post by Esp « Tue Sep 15, 2015 4:59 pm

by Esp » Tue Sep 15, 2015 4:59 pm
This topic was posted 3293 days ago

0 Replies

2929 Views

Last post by Esp
Tue Sep 15, 2015 4:59 pm
Changing PAW radius

Last post by raul_l « Wed Aug 26, 2015 3:36 pm
Replies: 1
by marsoner » Tue Aug 18, 2015 2:18 pm
This topic was posted 3321 days ago

1 Replies

3958 Views

Last post by raul_l
Wed Aug 26, 2015 3:36 pm
error for JTH PAW atomic datasets table [SOLVED]

Last post by jianzhifu « Mon Aug 17, 2015 11:31 am
Replies: 3
by jianzhifu » Tue Jun 02, 2015 3:10 am
This topic was posted 3398 days ago

3 Replies

7152 Views

Last post by jianzhifu
Mon Aug 17, 2015 11:31 am
Issue with Ge PAW atomic datasets

Last post by fudong « Tue Jul 14, 2015 4:41 pm
Replies: 2
by fudong » Wed Jul 01, 2015 5:16 pm
This topic was posted 3369 days ago

2 Replies

5159 Views

Last post by fudong
Tue Jul 14, 2015 4:41 pm
Weird behaviour of Ti pseudo with core correction

Last post by andreaschiaf « Tue Jun 23, 2015 6:20 pm

by andreaschiaf » Tue Jun 23, 2015 6:20 pm
This topic was posted 3377 days ago

0 Replies

3030 Views

Last post by andreaschiaf
Tue Jun 23, 2015 6:20 pm
PAW pseudopotentials with GGA of PBE XC functional

Last post by Seba Darshan « Tue Jun 09, 2015 5:49 pm
Replies: 2
by Seba Darshan » Tue Jun 09, 2015 8:29 am
This topic was posted 3391 days ago

2 Replies

4286 Views

Last post by Seba Darshan
Tue Jun 09, 2015 5:49 pm
Segfault when linking with Wannier90

Last post by pouillon « Tue Jun 09, 2015 1:20 pm
Replies: 8
by esr3d » Tue Dec 02, 2014 4:10 am
This topic was posted 3580 days ago

8 Replies

9929 Views

Last post by pouillon
Tue Jun 09, 2015 1:20 pm
pseudopotential for LiH or HCl

Last post by jzwanzig « Fri May 29, 2015 9:17 pm
Replies: 1
by abdo90 » Tue May 26, 2015 11:53 am
This topic was posted 3405 days ago

1 Replies

3435 Views

Last post by jzwanzig
Fri May 29, 2015 9:17 pm
abipy test error

Last post by sheng « Mon May 18, 2015 2:26 pm

by sheng » Mon May 18, 2015 2:26 pm
This topic was posted 3413 days ago

0 Replies

3426 Views

Last post by sheng
Mon May 18, 2015 2:26 pm
singl atom of axygen

Last post by abdo90 « Thu May 14, 2015 12:20 pm
Replies: 2
by abdo90 » Fri May 08, 2015 12:33 pm
This topic was posted 3423 days ago

2 Replies

3789 Views

Last post by abdo90
Thu May 14, 2015 12:20 pm
virtual crystal approximate

Last post by gswylq « Tue May 12, 2015 2:23 pm
Replies: 2
by gswylq » Mon May 11, 2015 5:02 am
This topic was posted 3420 days ago

2 Replies

4349 Views

Last post by gswylq
Tue May 12, 2015 2:23 pm
PAW potentials for quartz SiO2

Last post by jzwanzig « Mon May 04, 2015 1:38 pm
Replies: 1
by jeb » Mon Mar 23, 2015 8:06 pm
This topic was posted 3469 days ago

1 Replies

3419 Views

Last post by jzwanzig
Mon May 04, 2015 1:38 pm
Normalization of the real-space wave function

Last post by jzwanzig « Mon May 04, 2015 1:35 pm
Replies: 1
by freude » Tue Apr 07, 2015 11:08 am
This topic was posted 3454 days ago

1 Replies

3731 Views

Last post by jzwanzig
Mon May 04, 2015 1:35 pm
A bug in a spin-orbit coupling calculation, with nspden = 1

Last post by jzwanzig « Mon May 04, 2015 1:26 pm
Replies: 1
by yongchao.jia » Tue Apr 07, 2015 12:01 pm
This topic was posted 3454 days ago

1 Replies

3315 Views

Last post by jzwanzig
Mon May 04, 2015 1:26 pm
HSE hybrid functional in Abinit

Last post by Lantao « Thu Apr 09, 2015 1:10 pm
Replies: 2
by pseu » Wed Mar 25, 2015 3:00 pm
This topic was posted 3467 days ago

2 Replies

4612 Views

Last post by Lantao
Thu Apr 09, 2015 1:10 pm
PAW pseudopotential for He in .paw format

Last post by Jordan « Wed Apr 01, 2015 5:15 pm
Replies: 5
by icez » Mon Dec 09, 2013 11:27 pm
This topic was posted 3938 days ago

5 Replies

7443 Views

Last post by Jordan
Wed Apr 01, 2015 5:15 pm
Error when using PAW

Last post by mrgm « Sat Feb 28, 2015 8:48 pm

by mrgm » Sat Feb 28, 2015 8:48 pm
This topic was posted 3492 days ago

0 Replies

2570 Views

Last post by mrgm
Sat Feb 28, 2015 8:48 pm
problems in LDA-TM potential

Last post by ntuxi « Mon Jan 05, 2015 7:50 am

by ntuxi » Mon Jan 05, 2015 7:50 am
This topic was posted 3546 days ago

0 Replies

2592 Views

Last post by ntuxi
Mon Jan 05, 2015 7:50 am
phosphorus with Tb-mbj+correlation potential of PW91

Last post by kazem.manzoor « Tue Dec 30, 2014 1:48 pm

by kazem.manzoor » Tue Dec 30, 2014 1:48 pm
This topic was posted 3552 days ago

0 Replies

2748 Views

Last post by kazem.manzoor
Tue Dec 30, 2014 1:48 pm
test pseudo-potentiel

Last post by rahmaniahlem « Sun Dec 28, 2014 9:43 am

by rahmaniahlem » Sun Dec 28, 2014 9:43 am
This topic was posted 3554 days ago

0 Replies

2418 Views

Last post by rahmaniahlem
Sun Dec 28, 2014 9:43 am
glibc error detected with relaxation spin orbit coupling

Last post by sheng « Sat Dec 06, 2014 4:39 am

by sheng » Sat Dec 06, 2014 4:39 am
This topic was posted 3576 days ago

0 Replies

2395 Views

Last post by sheng
Sat Dec 06, 2014 4:39 am
Strange forces in band-parallelizations with PAW

Last post by Jordan « Thu Dec 04, 2014 9:16 am
Replies: 4
by goodwill » Thu Nov 27, 2014 7:27 am
This topic was posted 3585 days ago

4 Replies

4322 Views

Last post by Jordan
Thu Dec 04, 2014 9:16 am
Forces in an electric field using PAW

Last post by Jordan « Mon Oct 20, 2014 9:57 am
Replies: 1
by dtom0352 » Fri Oct 10, 2014 6:11 pm
This topic was posted 3633 days ago

1 Replies

3216 Views

Last post by Jordan
Mon Oct 20, 2014 9:57 am
A question of Born effective charge

Last post by yongchao.jia « Thu Oct 16, 2014 3:36 pm

by yongchao.jia » Thu Oct 16, 2014 3:36 pm
This topic was posted 3627 days ago

0 Replies

3807 Views

Last post by yongchao.jia
Thu Oct 16, 2014 3:36 pm
"Big problem with the spin orbit in PSP5NL"

Last post by emilgojny « Tue Oct 07, 2014 10:14 pm
Replies: 2
by temok » Fri Jul 25, 2014 5:55 am
This topic was posted 3710 days ago

2 Replies

4550 Views

Last post by emilgojny
Tue Oct 07, 2014 10:14 pm

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