[Wien] error in nn

Arun Kr. Chatterjee aruna_c at vsnl.net
Fri Jun 19 21:14:31 CEST 2009


Dear all user,
 I am working with a compound of vanadium having orthorohmbic structure with space group Pmmn. In my calculation I have taken RMT(1)=2 ,RMT(2)=1.9 and bond length =1.89 A. When the program nn is executed with command x nn I am getting error which looks like:
RMT(1)=2 and RMT(2)=1.9 sums to 3.9 GT NNN-DIST= 2.43
Can anyone  help to  resolve this problem?
 
Arun
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