[Wien] error in nn

shamik chakrabarti shamikphy at gmail.com
Thu Jan 28 04:15:39 CET 2016


Dear wien2k users,

                          We have tried to simulate a heusler alloy. During
initialization it shows input conversion error. I am appending the error
below.

forrtl: severe (64): input conversion error, unit 20, file
/home/akdas/Srimanta/GGA+U/Co2FeGe_optimised2/Co2FeGe_optimised2.struct
Image              PC                Routine            Line
Source
nn                 000000000042FFA9  Unknown               Unknown  Unknown
nn                 0000000000404258  MAIN__                    138  nn.f
nn                 0000000000403256  Unknown               Unknown  Unknown
libc.so.6          0000003E0FC1ED1D  Unknown               Unknown  Unknown
nn                 0000000000403149  Unknown               Unknown  Unknown
0.002u 0.001s 0:10.85 0.0%    0+0k 0+16io 0pf+0w
error: command   /usr/local/bin/WIEN2K_14/nn nn.def   failed
 n stop error n

Is it due to some error in the struct file?..

Looking forward to your response in this regard.

Thanks in advance,

with regards,
-- 
Dr. Shamik Chakrabarti
Research Associate
Electroceramics Lab
Dept. of Metallurgical & Materials Engineering
IIT Kharagpur
Kharagpur 721302
INDIA
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