[Pw_forum] Errors in examples of QuantumEspresso
Paolo Giannozzi
giannozz at democritos.it
Wed Jul 8 12:37:52 CEST 2009
On Jul 8, 2009, at 13:15 , leila salimi wrote:
> from ewald : error # 1
> optimal alpha not found
wasn't it explained a few days ago by LP? newer IBM
compilers have made a mess with the error function
(erf, erfc)
P.
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Paolo Giannozzi, Dept of Physics, University of Udine
via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
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