When I submitted a job, vasp showed the following error message:
"LDA part: xc-table for Ceperly-Alder, Vosko type interpolation para-ferro
No initial positions read in"
Here's my POSCAR:
Pt - (211) 2x2x3
3.98
3.46410 0.00000 0.00000
0.00000 1.41421 0.00000
0.00000 0.00000 2.95673
12
selective dynamics
direct
0.16667 0.00000 0.00000 F F F
0.66667 0.00000 0.00000 F F F
0.16667 0.50000 0.00000 F F F
0.66667 0.50000 0.00000 F F F
0.33333 0.25000 0.06904 T T T
0.83333 0.25000 0.06904 T T T
0.33333 0.75000 0.06904 T T T
0.83333 0.75000 0.06904 T T T
0.00000 0.00000 0.13807 T T T
0.50000 0.00000 0.13807 T T T
0.00000 0.50000 0.13807 T T T
0.50000 0.50000 0.13807 T T T
Could anyone help me where I went wrong?
Thanks for the help
Error message
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cooljansen2
Error message
Last edited by cooljansen2 on Sun Jul 01, 2012 6:57 pm, edited 1 time in total.
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admin
- Administrator
- Posts: 2921
- Joined: Tue Aug 03, 2004 8:18 am
- License Nr.: 458
Error message
POSCAR is OK. Check for special (invisible) characters which can be introduced by the text editor at the end of lines.
Last edited by admin on Tue Jul 03, 2012 12:37 pm, edited 1 time in total.
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alex
- Hero Member
- Posts: 585
- Joined: Tue Nov 16, 2004 2:21 pm
- License Nr.: 5-67
- Location: Germany
Error message
Does your POSCAR eventually start with an empty line? It's not clear from your posting ...
Last edited by alex on Wed Jul 04, 2012 10:38 am, edited 1 time in total.