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Sub-Space matrix not Hermitian in DAV

Last post by admin « Fri Aug 17, 2007 9:24 am
Replies: 1
by vikram3 » Thu Aug 16, 2007 12:40 pm

1 Replies

13013 Views

Last post by admin
Fri Aug 17, 2007 9:24 am
RWIG in the INCAR ? is it angstrom ?

Last post by admin « Thu Aug 16, 2007 9:27 am
Replies: 1
by baknoo » Thu Aug 16, 2007 12:59 am

1 Replies

7777 Views

Last post by admin
Thu Aug 16, 2007 9:27 am
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

8745 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

13785 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

10809 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

11065 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

8796 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

8281 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

10832 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

10237 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

12236 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

8704 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

9037 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

10756 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

9754 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

14035 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

7326 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

9108 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

11288 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

7382 Views

Last post by admin
Fri May 25, 2007 11:58 am

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