<table cellspacing="0" cellpadding="0" border="0" ><tr><td valign="top" style="font: inherit;">dear wien2k user's<br><br>i have a quad proc my operating system is opensuse 10.3 64bits<br>i'm using the wien2k_09 version compiled with ifort11.1 and linked with mkl10.2<br>my question is about the bandstructure calculation :<br>when i insert the xcrysden.klist or change unit in .in1c from 4 to 5<br>i have the following message of error:<br><br>Commandline: x lapw1 -band -c<br>Program input is: ""<br><br>forrtl: severe (64): input conversion error, unit 5, file /home/workwien/LiIO3_band/LiIO3_band.in1c<br>Image PC Routine Line
Source <br>lapw1c 00000000005132BD Unknown Unknown Unknown<br>lapw1c 0000000000511DC5 Unknown Unknown Unknown<br>lapw1c 00000000004B1B90 Unknown Unknown Unknown<br>lapw1c 000000000046B39A Unknown Unknown
Unknown<br>lapw1c 000000000046AB90 Unknown Unknown Unknown<br>lapw1c 000000000048DAC3 Unknown Unknown Unknown<br>lapw1c 000000000042FBEB inilpw_ 523 inilpw.f<br>lapw1c 0000000000430A3C MAIN__ 41
lapw1_tmp_.F<br>lapw1c 0000000000404E2C Unknown Unknown Unknown<br>libc.so.6 00002ACFF703CB54 Unknown Unknown Unknown<br>lapw1c 0000000000404D59 Unknown Unknown Unknown<br>0.412u 0.216s 0:00.62 100.0% 0+0k 0+0io 0pf+0w<br>error: command /home/wien/lapw1c lapw1.def failed<br><br><br>any suggestion or help please<br>thank you in advance<br><br><br></td></tr></table><br>