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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 4061 days ago

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

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optimization

Last post by zjuer « Thu Apr 14, 2011 5:07 pm

by zjuer » Thu Apr 14, 2011 5:07 pm
This topic was posted 4908 days ago

0 Replies

2080 Views

Last post by zjuer
Thu Apr 14, 2011 5:07 pm
charged unit cell

Last post by zjuer « Wed Apr 13, 2011 11:17 pm

by zjuer » Wed Apr 13, 2011 11:17 pm
This topic was posted 4909 days ago

0 Replies

1916 Views

Last post by zjuer
Wed Apr 13, 2011 11:17 pm
How can I calculate the volume of Ti55 icosahedron?

Last post by andreichibisov « Wed Apr 13, 2011 5:22 am

by andreichibisov » Wed Apr 13, 2011 5:22 am
This topic was posted 4910 days ago

0 Replies

1901 Views

Last post by andreichibisov
Wed Apr 13, 2011 5:22 am
total energy cannot converge

Last post by andreichibisov « Sat Apr 09, 2011 3:06 pm

by andreichibisov » Sat Apr 09, 2011 3:06 pm
This topic was posted 4913 days ago

0 Replies

2055 Views

Last post by andreichibisov
Sat Apr 09, 2011 3:06 pm
Calculation of charged atoms

Last post by ksarek « Tue Apr 05, 2011 10:44 am

by ksarek » Tue Apr 05, 2011 10:44 am
This topic was posted 4918 days ago

0 Replies

1960 Views

Last post by ksarek
Tue Apr 05, 2011 10:44 am
how to set vacuum in a slab

Last post by apascon « Thu Mar 31, 2011 4:36 pm

by apascon » Thu Mar 31, 2011 4:36 pm
This topic was posted 4922 days ago

0 Replies

2230 Views

Last post by apascon
Thu Mar 31, 2011 4:36 pm
Wavefunction output

Last post by zjuer « Sun Mar 27, 2011 9:56 pm
Replies: 2
by zjuer » Sat Mar 26, 2011 2:17 am
This topic was posted 4928 days ago

2 Replies

2288 Views

Last post by zjuer
Sun Mar 27, 2011 9:56 pm
[RESOLVED] Writing problems in abinit outputs

Last post by acastanedam « Sun Mar 27, 2011 7:09 pm
Replies: 4
by acastanedam » Sun Mar 06, 2011 7:05 pm
This topic was posted 4947 days ago

4 Replies

4781 Views

Last post by acastanedam
Sun Mar 27, 2011 7:09 pm
Band structure of the ZnS??

Last post by new_986 « Sun Mar 27, 2011 12:50 pm

by new_986 » Sun Mar 27, 2011 12:50 pm
This topic was posted 4927 days ago

0 Replies

2331 Views

Last post by new_986
Sun Mar 27, 2011 12:50 pm
force cannot converge

Last post by guitar « Fri Mar 25, 2011 3:34 am

by guitar » Fri Mar 25, 2011 3:34 am
This topic was posted 4929 days ago

0 Replies

2136 Views

Last post by guitar
Fri Mar 25, 2011 3:34 am
K-point, G-vectors and Bands parallelization

Last post by luca.sementa « Wed Mar 23, 2011 5:43 pm

by luca.sementa » Wed Mar 23, 2011 5:43 pm
This topic was posted 4930 days ago

0 Replies

2265 Views

Last post by luca.sementa
Wed Mar 23, 2011 5:43 pm
K-point

Last post by Alain_Jacques « Tue Mar 22, 2011 1:28 pm
Replies: 2
by Amal Giri » Tue Mar 22, 2011 7:59 am
This topic was posted 4932 days ago

2 Replies

2784 Views

Last post by Alain_Jacques
Tue Mar 22, 2011 1:28 pm
calculation terminated for bands calculation

Last post by hplan « Mon Mar 21, 2011 9:53 am

by hplan » Mon Mar 21, 2011 9:53 am
This topic was posted 4933 days ago

0 Replies

2429 Views

Last post by hplan
Mon Mar 21, 2011 9:53 am
Questions on the rprim's non-uniqueness.

Last post by hicpalm « Thu Mar 17, 2011 11:47 am
Replies: 4
by zhaohs » Sun Mar 13, 2011 4:14 am
This topic was posted 4941 days ago

4 Replies

3805 Views

Last post by hicpalm
Thu Mar 17, 2011 11:47 am
polymorphism and symmetry

Last post by hicpalm « Thu Mar 17, 2011 11:02 am
Replies: 2
by hicpalm » Sat Dec 25, 2010 11:07 am
This topic was posted 5019 days ago

2 Replies

3134 Views

Last post by hicpalm
Thu Mar 17, 2011 11:02 am
Germanium and structure optimization

Last post by hicpalm « Wed Mar 16, 2011 5:46 pm
Replies: 8
by herman » Mon Jan 10, 2011 10:58 am
This topic was posted 5003 days ago

8 Replies

8190 Views

Last post by hicpalm
Wed Mar 16, 2011 5:46 pm
Abinit kpoint grid generation and kptrlen

Last post by mverstra « Mon Mar 14, 2011 2:58 pm
Replies: 1
by Boris » Sat Mar 12, 2011 12:20 am
This topic was posted 4942 days ago

1 Replies

2246 Views

Last post by mverstra
Mon Mar 14, 2011 2:58 pm
Problem in generating monoclinic cells

Last post by renyu « Wed Mar 09, 2011 2:29 am
Replies: 2
by renyu » Tue Mar 08, 2011 9:42 pm
This topic was posted 4945 days ago

2 Replies

3533 Views

Last post by renyu
Wed Mar 09, 2011 2:29 am
Bug in prtcif?

Last post by maurosgroi « Tue Mar 08, 2011 9:01 pm
Replies: 4
by maurosgroi » Wed Jan 12, 2011 2:58 pm
This topic was posted 5000 days ago

4 Replies

3715 Views

Last post by maurosgroi
Tue Mar 08, 2011 9:01 pm
reduce memory

Last post by chen « Sun Mar 06, 2011 6:19 pm
Replies: 2
by chen » Tue Mar 01, 2011 11:31 pm
This topic was posted 4952 days ago

2 Replies

3497 Views

Last post by chen
Sun Mar 06, 2011 6:19 pm
Problem with the "dilatmx" in the structure optimization

Last post by lxbyf « Sun Mar 06, 2011 5:31 am
Replies: 2
by lxbyf » Thu Feb 24, 2011 4:50 pm
This topic was posted 4957 days ago

2 Replies

3076 Views

Last post by lxbyf
Sun Mar 06, 2011 5:31 am
relaxation under stress with abinit

Last post by mverstra « Sat Mar 05, 2011 12:04 am
Replies: 1
by akersch » Sat Jan 22, 2011 4:38 pm
This topic was posted 4990 days ago

1 Replies

2772 Views

Last post by mverstra
Sat Mar 05, 2011 12:04 am
LSDA option - difference of up/dn spin

Last post by mverstra « Sat Mar 05, 2011 12:00 am
Replies: 1
by bjeon » Sat Jan 29, 2011 10:06 pm
This topic was posted 4983 days ago

1 Replies

2676 Views

Last post by mverstra
Sat Mar 05, 2011 12:00 am
GUI for generatin input files

Last post by mverstra « Fri Mar 04, 2011 11:51 pm
Replies: 5
by hatuey » Tue Mar 23, 2010 3:40 pm
This topic was posted 5295 days ago

5 Replies

5480 Views

Last post by mverstra
Fri Mar 04, 2011 11:51 pm
How to get m-resolved partial DOS (real spherical harmonics)

Last post by mverstra « Fri Mar 04, 2011 3:10 pm
Replies: 2
by isspwjlu » Thu Jan 13, 2011 1:31 am
This topic was posted 5000 days ago

2 Replies

2676 Views

Last post by mverstra
Fri Mar 04, 2011 3:10 pm

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