Re: [plumed-users] Plumed-2.0.4 with Quantum Espresso-5.0.2

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Giovanni Bussi

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Oct 14, 2014, 12:39:39 PM10/14/14
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Hi!

Could you check if compiling by hand one file before the other the problem is solved? If so we could just add a dependence in the Makefile.

Giovanni

On Tue, Oct 14, 2014 at 5:31 PM, Ider Ronneberger <ider.ron...@googlemail.com> wrote:
Hi,

I ran into a compilation error of Quantum Espresso-5.0.2. , after patching plumed-2.0.4.The compilation stops with the following error message:


plugin_initialization.f90(20): error #7002: Error in opening the compiled module file.  Check INCLUDE paths.   [DYNAMICS_MODULE]
  USE dynamics_module,  ONLY : dt
------^
plugin_initialization.f90(53): error #6404: This name does not have a type, and must have an explicit type.   [DT]
            call plumed_f_gcmd("setTimestep"//char(0),dt);
------------------------------------------------------^
plugin_initialization.f90(20): error #6580: Name in only-list does not exist.   [DT]
  USE dynamics_module,  ONLY : dt
-------------------------------^
compilation aborted for plugin_initialization.f90 (code 1)
make[2]: *** [plugin_initialization.o] Error 1
make[2]: *** Waiting for unfinished jobs....
make[2]: Leaving directory `/rwthfs/rz/cluster/home/ir801803/Programs/espresso-5.0.2/PW/src'
make[1]: *** [pw] Error 2
make[1]: Leaving directory `/rwthfs/rz/cluster/home/ir801803/Programs/espresso-5.0.2/PW'
make: *** [pw] Error 2

The file dynamics_module.f90 should be probably compiled first, before plugin_initialization.f90.

Best regards,

Ider

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