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phonons with hexagonal symmetry and IBRION=6

Last post by jsfilhol « Mon Feb 08, 2010 9:47 am
Replies: 2
by widom » Wed Jan 27, 2010 4:35 pm

2 Replies

6954 Views

Last post by jsfilhol
Mon Feb 08, 2010 9:47 am
Energy vs Volume ... the usual problem (?)

Last post by schani « Tue Feb 02, 2010 9:33 pm
Replies: 1
by schani » Mon Feb 01, 2010 2:22 pm

1 Replies

4569 Views

Last post by schani
Tue Feb 02, 2010 9:33 pm
WARNING: CNORMN: search vector ill defined

Last post by admin « Tue Jan 19, 2010 1:26 pm
Replies: 6
by q365 » Tue Apr 21, 2009 5:52 pm

6 Replies

16178 Views

Last post by admin
Tue Jan 19, 2010 1:26 pm
position of Fermi level wrt vacuum

Last post by alex « Thu Jan 14, 2010 2:13 pm
Replies: 3
by dkanan » Wed Jan 13, 2010 9:21 pm

3 Replies

8076 Views

Last post by alex
Thu Jan 14, 2010 2:13 pm
AM05 not working

Last post by VASP001 « Sat Jan 09, 2010 6:07 pm
Replies: 4
by jsfilhol » Wed Jul 22, 2009 8:23 am

4 Replies

7727 Views

Last post by VASP001
Sat Jan 09, 2010 6:07 pm
The questions about the optimization of SIGMA ?

Last post by forsdan « Sun Dec 27, 2009 8:42 am
Replies: 3
by VASP001 » Sat Dec 26, 2009 4:42 pm

3 Replies

7452 Views

Last post by forsdan
Sun Dec 27, 2009 8:42 am
What do this time mean ?

Last post by pkroll « Sun Dec 27, 2009 4:28 am
Replies: 1
by VASP001 » Sun Dec 27, 2009 1:28 am

1 Replies

6286 Views

Last post by pkroll
Sun Dec 27, 2009 4:28 am
kpoints and waveder in GW

Last post by applelinux « Tue Dec 22, 2009 6:02 pm
Replies: 1
by linn54 » Sat Aug 29, 2009 4:51 pm

1 Replies

6758 Views

Last post by applelinux
Tue Dec 22, 2009 6:02 pm
A convergence problem with Al and Al alloys

Last post by alex « Tue Dec 22, 2009 11:59 am
Replies: 1
by riche » Mon Dec 21, 2009 9:38 pm

1 Replies

4108 Views

Last post by alex
Tue Dec 22, 2009 11:59 am
Accurately Modeling STM dI/dV Spectra

Last post by mrm « Sun Dec 20, 2009 9:47 pm
Replies: 2
by mrm » Tue Nov 03, 2009 1:28 am

2 Replies

6569 Views

Last post by mrm
Sun Dec 20, 2009 9:47 pm
SIGSEGV, segmentation fault occurred

Last post by zyyin « Sun Dec 13, 2009 1:24 pm
Replies: 1
by zyyin » Sun Dec 13, 2009 12:31 pm

1 Replies

6169 Views

Last post by zyyin
Sun Dec 13, 2009 1:24 pm
LEPSILON with gamma point VASP

Last post by admin « Mon Dec 07, 2009 8:27 am
Replies: 3
by tholme » Mon Nov 30, 2009 11:34 pm

3 Replies

6932 Views

Last post by admin
Mon Dec 07, 2009 8:27 am
system-shutdown; contact gK immediately

Last post by lyon0100 « Mon Dec 07, 2009 12:17 am
Replies: 3
by lahaye » Sat Jul 01, 2006 12:48 am

3 Replies

8700 Views

Last post by lyon0100
Mon Dec 07, 2009 12:17 am
Supercell Energy Scaling

Last post by dpsi « Tue Dec 01, 2009 3:21 pm
Replies: 2
by dpsi » Thu Nov 05, 2009 9:42 am

2 Replies

6747 Views

Last post by dpsi
Tue Dec 01, 2009 3:21 pm
Calculate self-energy corrections for specific bands in GW calculation

Last post by admin « Mon Nov 30, 2009 10:34 am
Replies: 1
by itamblyn » Tue Oct 20, 2009 12:14 am

1 Replies

5019 Views

Last post by admin
Mon Nov 30, 2009 10:34 am
Poblem in CHGCAR and WAVECAR

Last post by yinwei_li « Tue Nov 17, 2009 11:03 am
Replies: 8
by Yeneneh » Mon Jan 23, 2006 1:03 pm

8 Replies

25814 Views

Last post by yinwei_li
Tue Nov 17, 2009 11:03 am
changing kpoints

Last post by tholme « Tue Nov 10, 2009 11:40 pm
Replies: 2
by tholme » Wed Oct 28, 2009 5:41 pm

2 Replies

6292 Views

Last post by tholme
Tue Nov 10, 2009 11:40 pm
Warning :The distance between some ions is very small

Last post by sabmaj « Fri Nov 06, 2009 2:43 pm
Replies: 2
by sabmaj » Thu Nov 05, 2009 6:58 pm

2 Replies

8069 Views

Last post by sabmaj
Fri Nov 06, 2009 2:43 pm
atomic energy

Last post by forsdan « Sun Oct 18, 2009 8:16 am
Replies: 1
by D.H.Tang » Sat Oct 17, 2009 8:40 am

1 Replies

4732 Views

Last post by forsdan
Sun Oct 18, 2009 8:16 am
WARNING: Sub-Space-Matrix is not hermitian in DAV

Last post by admin « Mon Oct 12, 2009 12:04 pm
Replies: 1
by dcosta » Mon Jul 27, 2009 8:39 am

1 Replies

12544 Views

Last post by admin
Mon Oct 12, 2009 12:04 pm

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