[Wien] about supercell code
Amin Babazadeh
babazade at gmail.com
Mon Jul 10 10:16:56 CEST 2006
dear users
Is there differnt between the supercell code that had been used in Wien2k_05
and Wien2k_06?
I made a supercell for a case in wien2k_05 ,successfuly. But when i used the
same way for the same case in Wien2k_06 i was unsuccessful and i saw this
error.and know i don't know why?
the error is
Commandline: x supercell
Program input is: "ZnS.struct 2 2 2 P 0 N 0 N 0 N "
Program generates supercell from a WIEN struct file.
Filename of struct file:
Number of cells in x direction:
Number of cells in y direction:
Number of cells in z direction:
Optional shift all atoms by the same amount (fractional coordinates).
Please enter x shift:
Input/Output Error 137: Value not recognized
In Procedure: main program
At Line: 63
Statement: List-Directed READ
Unit: 5
Connected To: Stdin
Form: Formatted
Access: Sequential
Records Read : 5
Records Written: 0
Current I/O Buffer:
** Address Error **
End of diagnostics
0.000u 0.008s 0:00.07 0.0% 0+0k 0+0io 8pf+0w
error: command /home/amin/Wienroot/supercell supercell.def failed
--
AMIN
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