[Pw_forum] compiling problems of espresso-2.1.3 onIBM-rs6000???
phyliul at nus.edu.sg
Fri May 6 17:18:37 CEST 2005
Many thanks for your kind reply.
I try set "MYLIB = lapack", but still got "
** ON ENTRY TO ZHPEV PARAMETER NUMBER 1 HAD AN ILLEGAL VALUE"
>From archive searching results of Paolo's comments
"IBM with ESSL ? ESSL contains a version of ZHPEV that is incompatible
with ZHPEV provided by LAPACK. If __AIX is defined, the former is used.
Load ESSL before LAPACK.
I am very confused, that means I have to install a liblapack.a
separately together with essl?
Thanks and regards,
From: pw_forum-admin at pwscf.org [mailto:pw_forum-admin at pwscf.org] On
Behalf Of Gerardo Ballabio
Sent: Friday, May 06, 2005 3:57 PM
To: pw_forum at pwscf.org
Subject: Re: [Pw_forum] compiling problems of espresso-2.1.3
On 05/06/05 05:08:11, Liu Lei wrote:
> Yes, but essl is supposed to have all the math lib functions.
> LIBS="-lessl -L/usr/lib -llapack" does not work on our machine, as
> there is no liblapack.a file in the folder.
> Is there any way to solve this problem?
Yes, if lapack library is not installed on your machine, you can set
"MYLIB = lapack" in the make.sys file after configuration (configure
will probably set "MYLIB = blas_and_lapack", but if you do have essl,
you don't need blas).
Pw_forum mailing list
Pw_forum at pwscf.org
More information about the users