[Pw_forum] from invmat : error #1 singular matrix

Paolo Giannozzi giannozz at democritos.it
Mon Nov 30 11:05:02 CET 2009


Lim Chiang Huay, Freda wrote:

>      from  invmat  : error #         1
>       singular matrix

quick & dirty fix: edit flib/invmat.f90, remove the line
   IF (ABS(da) < 1.d-10) CALL errore(' invmat ',' singular matrix ',1)

P.
-- 
Paolo Giannozzi, Democritos and University of Udine, Italy



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