Dear Mr. Johnson and MPB Users

I tried a Loop to increase line defect of PCW, and study its effect of 
dispersion curve.
But facing Error:
CHECK failure on line 243 of ../../../../src/matrices/blasglue.c: non 
positive-definite matrix in potrf
then 
solve_kpoint(0.219355,0,0):
Solving for bands 1 to 6...
and MPB Broken and will not continue any Iteration.

the location of error is random, I mean some times in 5th titration and some 
time in other iteration this problem happened.
I searched on the forum, but unfortunately I Couldn't understand solution for 
this error.

I have to mention when I run examples or .Ctl file with few number of 
iteration, I will not face such a problem

Any Help!

Regards
Hassan


      
_______________________________________________
mpb-discuss mailing list
[email protected]
http://ab-initio.mit.edu/cgi-bin/mailman/listinfo/mpb-discuss

Reply via email to