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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

126874 Views

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

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VDW: option 7 No 3rd body interaction???

Last post by cespejo « Fri May 04, 2018 6:28 pm
Replies: 1
by johnbrehm » Mon Apr 23, 2018 8:19 pm
This topic was posted 2342 days ago

1 Replies

2694 Views

Last post by cespejo
Fri May 04, 2018 6:28 pm
SCF cycle deteriorates during molecular dynamics

Last post by Boris « Fri May 04, 2018 8:53 am
Replies: 7
by gabriel.antonius » Fri Apr 13, 2018 7:21 pm
This topic was posted 2352 days ago

7 Replies

7622 Views

Last post by Boris
Fri May 04, 2018 8:53 am
How to solve "Eigenvector with band 1 has zero norm"? [SOLVED]

Last post by ebousquet « Thu May 03, 2018 9:29 pm
Replies: 4
by FBNIC » Thu May 03, 2018 4:10 pm
This topic was posted 2332 days ago

4 Replies

3625 Views

Last post by ebousquet
Thu May 03, 2018 9:29 pm
How to setup a vacancy in a charged state?

Last post by Boris « Wed May 02, 2018 9:29 am
Replies: 1
by fhssn1 » Tue May 01, 2018 8:33 am
This topic was posted 2335 days ago

1 Replies

2673 Views

Last post by Boris
Wed May 02, 2018 9:29 am
paw+wavelet, is it available?

Last post by Harrybells « Wed Apr 25, 2018 7:49 am
Replies: 1
by yiwang_cn » Sun Jan 14, 2018 7:19 am
This topic was posted 2442 days ago

1 Replies

1766 Views

Last post by Harrybells
Wed Apr 25, 2018 7:49 am
band structur

Last post by amadon « Tue Apr 24, 2018 10:17 am
Replies: 1
by mustafa » Tue Apr 10, 2018 9:53 pm
This topic was posted 2355 days ago

1 Replies

2212 Views

Last post by amadon
Tue Apr 24, 2018 10:17 am
DFT+U

Last post by ebousquet « Mon Apr 23, 2018 2:36 pm
Replies: 2
by Fatima Zahra » Sun Apr 01, 2018 6:20 pm
This topic was posted 2364 days ago

2 Replies

2808 Views

Last post by ebousquet
Mon Apr 23, 2018 2:36 pm
DFT+U

Last post by amadon « Mon Apr 23, 2018 11:49 am
Replies: 1
by lakhal » Sun Sep 24, 2017 11:24 pm
This topic was posted 2553 days ago

1 Replies

2476 Views

Last post by amadon
Mon Apr 23, 2018 11:49 am
Increase SOC strength for band structure calculations?

Last post by amadon « Mon Apr 23, 2018 11:47 am
Replies: 1
by memelordjeff » Thu Jan 04, 2018 10:15 pm
This topic was posted 2451 days ago

1 Replies

2199 Views

Last post by amadon
Mon Apr 23, 2018 11:47 am
Unable to reproduce magnetic moment for YbN

Last post by ebousquet « Sun Apr 22, 2018 2:11 pm
Replies: 13
by fhssn1 » Thu Apr 12, 2018 6:27 am
This topic was posted 2354 days ago

13 Replies

12427 Views

Last post by ebousquet
Sun Apr 22, 2018 2:11 pm
istwfk variable

Last post by ebousquet « Wed Apr 18, 2018 10:18 pm
Replies: 1
by Alexander89 » Sat Apr 07, 2018 5:08 pm
This topic was posted 2358 days ago

1 Replies

1839 Views

Last post by ebousquet
Wed Apr 18, 2018 10:18 pm
toldfe for a primitive cell vs a supercell?

Last post by ebousquet « Wed Apr 18, 2018 10:13 pm
Replies: 1
by fhssn1 » Tue Apr 10, 2018 7:47 am
This topic was posted 2356 days ago

1 Replies

1765 Views

Last post by ebousquet
Wed Apr 18, 2018 10:13 pm
spin polarized convergence studies?

Last post by ebousquet « Wed Apr 18, 2018 10:08 pm
Replies: 1
by fhssn1 » Wed Apr 11, 2018 7:38 pm
This topic was posted 2354 days ago

1 Replies

2057 Views

Last post by ebousquet
Wed Apr 18, 2018 10:08 pm
DoS resolution in conduction bands, and prtdos

Last post by fhssn1 « Wed Apr 18, 2018 9:52 pm
Replies: 8
by fhssn1 » Sun Mar 25, 2018 6:47 am
This topic was posted 2372 days ago

8 Replies

7810 Views

Last post by fhssn1
Wed Apr 18, 2018 9:52 pm
structural relaxation for supercell with impurity

Last post by fhssn1 « Tue Apr 10, 2018 2:20 am
Replies: 9
by fhssn1 » Sun Mar 11, 2018 9:11 am
This topic was posted 2385 days ago

9 Replies

5980 Views

Last post by fhssn1
Tue Apr 10, 2018 2:20 am
finding of reduced coordinate

Last post by NPike « Mon Apr 09, 2018 10:11 pm
Replies: 1
by Rita Maji » Thu Mar 08, 2018 1:51 pm
This topic was posted 2388 days ago

1 Replies

1843 Views

Last post by NPike
Mon Apr 09, 2018 10:11 pm
xcart error, can't read floating point variable from string

Last post by NPike « Fri Apr 06, 2018 4:30 pm
Replies: 3
by stella » Tue Jan 16, 2018 1:49 am
This topic was posted 2440 days ago

3 Replies

3063 Views

Last post by NPike
Fri Apr 06, 2018 4:30 pm
question about molecule on surface [SOLVED]

Last post by ebousquet « Fri Mar 30, 2018 6:52 pm
Replies: 1
by baisxun » Fri Mar 30, 2018 5:19 am
This topic was posted 2367 days ago

1 Replies

2521 Views

Last post by ebousquet
Fri Mar 30, 2018 6:52 pm
Can ABINIT run one-dimensional material calculations? [SOLVED]

Last post by gfcjyb « Mon Mar 19, 2018 10:19 pm
Replies: 2
by gfcjyb » Sat Mar 17, 2018 2:10 am
This topic was posted 2380 days ago

2 Replies

2910 Views

Last post by gfcjyb
Mon Mar 19, 2018 10:19 pm
Atomic or metallic?

Last post by mverstra « Tue Mar 13, 2018 2:06 pm
Replies: 3
by fizixer » Sun Mar 11, 2018 10:13 pm
This topic was posted 2385 days ago

3 Replies

3051 Views

Last post by mverstra
Tue Mar 13, 2018 2:06 pm
band st and DOS for the same k-points

Last post by ebousquet « Wed Mar 07, 2018 11:21 pm
Replies: 7
by Ashish » Fri Feb 16, 2018 11:52 am
This topic was posted 2408 days ago

7 Replies

5418 Views

Last post by ebousquet
Wed Mar 07, 2018 11:21 pm
Convergence study of primitive cell applied to supercell?

Last post by ebousquet « Mon Mar 05, 2018 12:09 pm
Replies: 6
by fhssn1 » Mon Feb 26, 2018 10:37 pm
This topic was posted 2398 days ago

6 Replies

3727 Views

Last post by ebousquet
Mon Mar 05, 2018 12:09 pm
Finite electric field calculations without fixing ions

Last post by sevket simsek « Wed Feb 28, 2018 12:53 pm
Replies: 9
by Anwar » Mon Sep 19, 2011 11:29 am
This topic was posted 4750 days ago

9 Replies

6704 Views

Last post by sevket simsek
Wed Feb 28, 2018 12:53 pm
quaternary zinc blend compound

Last post by ebousquet « Thu Feb 22, 2018 9:32 pm
Replies: 1
by new_986 » Thu Feb 22, 2018 9:32 am
This topic was posted 2402 days ago

1 Replies

1708 Views

Last post by ebousquet
Thu Feb 22, 2018 9:32 pm
CIF file

Last post by ebousquet « Thu Feb 22, 2018 8:53 pm
Replies: 3
by DAHAME » Thu Feb 02, 2017 8:34 am
This topic was posted 2787 days ago

3 Replies

2788 Views

Last post by ebousquet
Thu Feb 22, 2018 8:53 pm

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