[Thermo_pw-forum] Compilation error

[Peter Derlet]

To the thermo_pw community

I have a problem in compiling the thermo_pw (1.4.1) code on our local 
linux farm (Red Hat Enterprise Linux Server release 7.9 (Maipo)). For 
compiling i use gcc/9.3.0 and openmpi/4.0.5_slurm, which also allows for 
successful installation and running of qe 6.7 . I am not sure how 
standard the openmpi version is, however it specific to the SLURM 
queuing system we use here.

The error appears below resulting in the termination of the compile:

/opt/psi/Compiler/openmpi/4.0.5_slurm/gcc/9.3.0/bin/mpif90 -O3 -g -cpp 
-D__FFTW3 -D__MPI   -I/psi/home/derlet/software/q-e//include 
-I/psi/home/derlet/software/q-e//FoX/finclude 
-I/psi/home/derlet/software/q-e//upflib 
-I/psi/home/derlet/software/q-e//XClib 
-I/psi/home/derlet/software/q-e//Modules 
-I/psi/home/derlet/software/q-e//FFTXlib 
-I/psi/home/derlet/software/q-e//LAXlib 
-I/psi/home/derlet/software/q-e//UtilXlib 
-I/psi/home/derlet/software/q-e//MBD 
-I/psi/home/derlet/software/q-e//FoX/finclude -I../../PW/src 
-I../../dft-d3 -I../../LR_Modules -I../../PHonon/PH -I../lib -I. -c 
addnlcc_zstar_eu_us.f90
addnlcc_zstar_eu_us.f90:15:23:

    15 |   USE funct,     ONLY : dft_is_gradient, dft_is_nonlocc
       |                       1
Error: Symbol ‘dft_is_gradient’ referenced at (1) not found in module 
‘funct’
addnlcc_zstar_eu_us.f90:82:16:

    82 |            IF ( dft_is_gradient() ) &
       |                1
Error: Function ‘dft_is_gradient’ at (1) has no IMPLICIT type
make[1]: *** [addnlcc_zstar_eu_us.o] Error 1
make[1]: Leaving directory `/psi/home/derlet/software/q-e/thermo_pw/qe'
make: *** [thermo_qe] Error 1

Does anyone have an idea of what might be going wrong?

Kind regards,

Peter

-- 
Prof. Dr. Peter Derlet
Condensed Matter Theory, Paul Scherrer Institut - Department of Materials, ETH Zurich
ph:  +41 (0)56 310 3164
web: www.psi.ch/en/lsm/people/peter-michael-derlet