[Wien] DOS of AFM calculation

[shiyaojun]

Dear wien2k users:
    I have run a AFM calculation, the init_lapw and SCF have been done. When I calculated the DOS, the spin-up of the DOS is finished successfully, but for the spin-dn,  run x tetra -dn, the error is :

forrtl: severe (64): input conversion error, unit 4, file /root/Desktop/WIEN2k/DyCu/DyCu.qtldn
Image              PC        Routine            Line        Source             
tetra              080AA1BF  Unknown               Unknown  Unknown
tetra              080A97DF  Unknown               Unknown  Unknown
tetra              080755E6  Unknown               Unknown  Unknown
tetra              080533D8  Unknown               Unknown  Unknown
tetra              08053073  Unknown               Unknown  Unknown
tetra              08060670  Unknown               Unknown  Unknown
tetra              0804C283  Unknown               Unknown  Unknown
tetra              08049D91  Unknown               Unknown  Unknown
libc.so.6          0041DDEC  Unknown               Unknown  Unknown
tetra              08049CA1  Unknown               Unknown  Unknown
0.064u 0.000s 0:00.12 50.0%	0+0k 0+0io 0pf+0w
error: command   /work/WIEN2k/tetra dntetra.def   failed

I don't know why, please give me some suggestion.

your sincerely,
shiyaojun






--

Ph.D. Candidate 
Yaojun Shi
Department of Materials Science and Engineering
Nanjing University of Science and Technology
Nanjing 210094, P. R. China
Tel/Fax: (+86 +25) 84315159
Email: shiyaojun at 163.com

 


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