Dear all,
I am facing a warning message while setting   nn-bondlength  as follows
nn (12:18:17)  specify nn-bondlength factor: (usually=2) [and optionally
dlimit, dstmax (about
  1.d-5, 20)]
2
WARNING: Mult not equal. PLEASE CHECK outputnn-file
WARNING: ityp not equal. PLEASE CHECK outputnn-file
NN created a new Bi2FeReO6_G-type.struct_nn file .
But when I use Old case.struct file I am able to enter into the next step .
But when I accept to use the new case.struct case it is just get stuck
there giving the error message as follows
 forrtl: severe (174): SIGSEGV, segmentation fault occurred
Image              PC                Routine            Line        Source

nn                 000000000040779C  MAIN__                    396  nn.f
nn                 000000000040312C  Unknown               Unknown  Unknown
libc.so.6          0000003F57A1ED5D  Unknown               Unknown  Unknown
nn                 0000000000403029  Unknown               Unknown  Unknown
0.022u 0.002s 0:06.38 0.3% 0+0k 0+480io 0pf+0w
error: command   /home/paresh/Downloads/WIEN2k_14.2/nn nn.def   failed
 n stop error n

 I am proceeding with the old case.struct file . Is there any problem if I
use old case.struct file for the calculation ? If yes kindly give me some
direction  to resolve the above problem .
Any help would be highly appreciated .

Kind Regards
Paresh Chandra Rout
Research Scholar
Indian Institute of Science Education and Research Bhopal
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