Dear users,<br> I encountered a problem about energy band with spin-orbit coupling. I have done the scf. Then selected the special k-point from xcrysden. After that compute energy and energyso with x lapw1 -c -band and x lapwso -c .The above process is all right. But when I executed " x spaghetti -so" after having edited the file case.insp, that went to wrong. The printing on the screen is as follows,<br> <span style="background-color: rgb(255, 0, 255);"><br> number of k-points read in case.vector= 161</span><br style="background-color: rgb(255, 0, 255);"><span style="background-color: rgb(255, 0, 255);">forrtl: severe (174): SIGSEGV, segmentation fault occurred</span><br style="background-color: rgb(255, 0, 255);"><span style="background-color: rgb(255, 0, 255);">Image
PC Routine Line Source</span><br style="background-color: rgb(255, 0, 255);"><span style="background-color: rgb(255, 0, 255);">libpthread.so.0 00002B3AE00CE140 Unknown Unknown Unknown</span><br style="background-color: rgb(255, 0, 255);"><span style="background-color: rgb(255, 0, 255);">spaghetti 0000000000465222 Unknown Unknown Unknown</span><br style="background-color: rgb(255, 0, 255);"><span style="background-color: rgb(255, 0, 255);">spaghetti
0000000000434880 Unknown Unknown Unknown</span><br style="background-color: rgb(255, 0, 255);"><span style="background-color: rgb(255, 0, 255);">spaghetti 000000000041034D Unknown Unknown Unknown</span><br style="background-color: rgb(255, 0, 255);"><span style="background-color: rgb(255, 0, 255);">spaghetti 00000000004037AA Unknown Unknown Unknown</span><br style="background-color: rgb(255, 0, 255);"><span style="background-color: rgb(255, 0, 255);">libc.so.6 00002B3AE034A154
Unknown Unknown Unknown</span><br style="background-color: rgb(255, 0, 255);"><span style="background-color: rgb(255, 0, 255);">spaghetti 00000000004036E9 Unknown Unknown Unknown</span><br style="background-color: rgb(255, 0, 255);"><span style="background-color: rgb(255, 0, 255);">0.332u 0.092s 0:00.42 100.0% 0+0k 0+0io 0pf+0w</span><br style="background-color: rgb(255, 0, 255);"><span style="background-color: rgb(255, 0, 255);">error: command /home/wangyi/wien2k/spaghetti spaghetti.def failed<br><br>If I executed " x spaghetti " without so, that is nothing wrong.<br>I don't know why this wrong occured.Any addvise will do me great help<br><br>Thank you in
advancd.<br> Mary<br></span><p> 
<hr size=1>Luggage? GPS? Comic books? <br>
Check out fitting <a href="http://us.rd.yahoo.com/evt=48249/*http://search.yahoo.com/search?fr=oni_on_mail&p=graduation+gifts&cs=bz"> gifts for grads</a> at Yahoo! Search.