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Ion Positions in OUTCAR Not Agreeing With That in POSCAR

Last post by admin « Mon Aug 06, 2007 10:25 am
Replies: 1
by Modey3 » Sun Aug 05, 2007 5:07 pm

1 Replies

10958 Views

Last post by admin
Mon Aug 06, 2007 10:25 am
monoclinic cell problem (LATTYP) - different lattice vectors different energy

Last post by admin « Fri Aug 03, 2007 8:38 am
Replies: 3
by Greekman » Tue Jul 31, 2007 8:47 am

3 Replies

17229 Views

Last post by admin
Fri Aug 03, 2007 8:38 am
Segmentation fault

Last post by admin « Fri Aug 03, 2007 8:32 am
Replies: 3
by rudra-b » Thu Jun 21, 2007 9:48 am

3 Replies

13908 Views

Last post by admin
Fri Aug 03, 2007 8:32 am
Possible bug in PAW_PBE Al_h

Last post by nickjer « Thu Aug 02, 2007 1:33 pm
Replies: 2
by nickjer » Tue Jul 31, 2007 5:27 pm

2 Replies

13777 Views

Last post by nickjer
Thu Aug 02, 2007 1:33 pm
VASP compiled with MPI_CHAIN crashed

Last post by pavel « Tue Jul 24, 2007 9:45 am
Replies: 1
by pavel » Thu Jul 12, 2007 7:51 am

1 Replies

10934 Views

Last post by pavel
Tue Jul 24, 2007 9:45 am
The influence of lib to total energy

Last post by admin « Sat Jul 21, 2007 4:45 pm
Replies: 1
by lanjh » Fri Jul 20, 2007 8:42 am

1 Replies

10392 Views

Last post by admin
Sat Jul 21, 2007 4:45 pm
how can add the dipole layer,thanks

Last post by dengfenglicqupt « Thu Jul 19, 2007 2:06 pm
Replies: 3
by dengfenglicqupt » Mon Jul 09, 2007 3:17 am

3 Replies

14015 Views

Last post by dengfenglicqupt
Thu Jul 19, 2007 2:06 pm
ISPIN / ISPIND tag

Last post by admin « Sun Jul 08, 2007 7:40 pm
Replies: 1
by edouard » Fri Jul 06, 2007 8:53 am

1 Replies

12644 Views

Last post by admin
Sun Jul 08, 2007 7:40 pm
help to solve P4-error for vasp question

Last post by admin « Mon Jul 02, 2007 8:12 am
Replies: 3
by bendix » Sun Jun 24, 2007 9:53 am

3 Replies

15150 Views

Last post by admin
Mon Jul 02, 2007 8:12 am
Frequent problem

Last post by admin « Mon Jul 02, 2007 6:13 am
Replies: 1
by midair77 » Thu Jun 28, 2007 10:30 pm

1 Replies

11036 Views

Last post by admin
Mon Jul 02, 2007 6:13 am
How I mention different atomic species in INCAR and POSCAR?

Last post by admin « Fri Jun 22, 2007 12:10 pm
Replies: 2
by aniket » Fri Jun 22, 2007 8:15 am

2 Replies

12240 Views

Last post by admin
Fri Jun 22, 2007 12:10 pm
error running POTCAR for Au (PAW_GGA)

Last post by admin « Fri Jun 15, 2007 11:14 am
Replies: 3
by vdima » Fri Jun 08, 2007 4:44 pm

3 Replies

13850 Views

Last post by admin
Fri Jun 15, 2007 11:14 am
problem to get PARCHG of each band

Last post by yuxiao_zihan « Fri Jun 08, 2007 1:27 pm
Replies: 2
by yuxiao_zihan » Tue Jun 05, 2007 12:14 pm

2 Replies

12529 Views

Last post by yuxiao_zihan
Fri Jun 08, 2007 1:27 pm
Lattice vector definition in POSCAR

Last post by admin « Tue Jun 05, 2007 9:57 am
Replies: 3
by stern » Wed May 30, 2007 2:41 pm

3 Replies

19419 Views

Last post by admin
Tue Jun 05, 2007 9:57 am
Error running VASP for the benchmark.tar.gz input files

Last post by admin « Thu May 31, 2007 10:40 am
Replies: 1
by vasp » Wed May 30, 2007 2:10 pm

1 Replies

9615 Views

Last post by admin
Thu May 31, 2007 10:40 am
energy in case of spiral calculations

Last post by xianghjun « Tue May 29, 2007 6:53 pm
Replies: 1
by xianghjun » Sat May 26, 2007 8:13 pm

1 Replies

11456 Views

Last post by xianghjun
Tue May 29, 2007 6:53 pm
Questions about the "Adsorption"

Last post by admin « Fri May 25, 2007 12:03 pm
Replies: 3
by juniorway » Thu May 10, 2007 12:20 pm

3 Replies

14749 Views

Last post by admin
Fri May 25, 2007 12:03 pm
CoO orbital m. moments

Last post by admin « Fri May 25, 2007 11:58 am
Replies: 1
by zibi » Fri May 25, 2007 8:17 am

1 Replies

9656 Views

Last post by admin
Fri May 25, 2007 11:58 am
Compiler error in fft3dlib.f90

Last post by job « Wed May 23, 2007 1:15 pm
Replies: 7
by bendix » Mon Jan 08, 2007 2:41 am

7 Replies

25875 Views

Last post by job
Wed May 23, 2007 1:15 pm
Question about MAGMOM direction

Last post by admin « Fri May 18, 2007 11:20 am
Replies: 3
by chenweiguang » Thu Jul 06, 2006 1:41 pm

3 Replies

15938 Views

Last post by admin
Fri May 18, 2007 11:20 am

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