[CP2K-user] [CP2K:12013] Plumed2 error during CP2K build

Krack Matthias (PSI) matthi... at psi.ch
Wed Jul 31 07:43:07 UTC 2019


Hi Jerry

Can you post your arch file, the content of “plumed/2.5.2/lib/plumed/src/lib/Plumed.inc.static” (which contains the definition of PLUMED_DEPENDENCIES), and the error log again.

Best regards

Matthias

From: cp... at googlegroups.com <cp... at googlegroups.com> On Behalf Of Jerry Tanoury
Sent: Dienstag, 30. Juli 2019 19:42
To: cp2k <cp... at googlegroups.com>
Subject: Re: [CP2K:12013] Plumed2 error during CP2K build

Thank you Matthias.  I built plumed-2.5.2 using "--prefix=/cluster/home/tanoury/plumed-2.5.2 CC=mpiicc FC=mpiifort CXX=mpiicpc LIBS=-mkl", updated my arch file to fix LIBS, but got the same error messages and a failed install.

Am I missing something in my plumed2 install??

Best regards,
Jerry

On Monday, July 29, 2019 at 12:07:48 PM UTC-4, Matthias Krack wrote:
PS: The current trunk CP2K version links also with plumed 2.5.2 cleanly. Check your arch file, since you commented the first line starting with LIBS. Make sure that libplumed.a.is<http://libplumed.a.is> included in the link step.

HTH

Matthias

On Monday, 29 July 2019 16:40:34 UTC+2, Matthias Krack wrote:
Hi Jerry

The regression tester work with plumed version 2.4.1 including the one your arch file is based on.

Best regards

Matthias

From: c... at googlegroups.com<javascript:> <c... at googlegroups.com<javascript:>> On Behalf Of Jerry Tanoury
Sent: Montag, 29. Juli 2019 16:21
To: cp2k <c... at googlegroups.com<javascript:>>
Subject: [CP2K:12000] Plumed2 error during CP2K build

Dear Forum,

I am building CP2K using commit dba3465 from the dashboard, but I'm getting the following Plumed2 related error in the attached file.  I have also attached my arch file.  I greatly appreciate any help on fixing this.

Best regards,
Jerry
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