Hi everyone,
I am facing problem while compiling the exciting oxygen file in ubantu. I have gone through the processes that are suggested in the discussion of Compilation error exciting_oxygen on Ubuntu, but I am still facing the error. The website says,
If compilation fails, manual editing of the file make.inc inside $EXCITINGROOT/build may be required.
If someone could guide me how to proceed ahead, I will be extremely grateful. The error and make.inc file are as follows:
make[3]: Entering directory ‘/home/tutorials/exciting/build/serial’
gfortran -O3 -march=native -ffree-line-length-0 -cpp -DXS -DISO -DLIBXC -I./finclude -c …/…/src/fftlib/cfftnd.f90
…/…/src/fftlib/cfftnd.f90:573:72:
573 | call cmf2kf ( lot, ido, l1, na, c, jump, inc, ch, 1, lot, wa(iw) )
| 1
Error: Type mismatch in argument ‘cc’ at (1); passed COMPLEX(8) to REAL(8)
…/…/src/fftlib/cfftnd.f90:575:72:
575 | call cmf2kf ( lot, ido, l1, na, ch, 1, lot, c, jump, inc, wa(iw) )
| 1
Error: Type mismatch in argument ‘ch’ at (1); passed COMPLEX(8) to REAL(8)
…/…/src/fftlib/cfftnd.f90:577:72:
577 | call cmf3kf ( lot, ido, l1, na, c, jump, inc, ch, 1, lot, wa(iw) )
| 1
Error: Type mismatch in argument ‘cc’ at (1); passed COMPLEX(8) to REAL(8)
…/…/src/fftlib/cfftnd.f90:579:72:
579 | call cmf3kf ( lot, ido, l1, na, ch, 1, lot, c, jump, inc, wa(iw) )
| 1
Error: Type mismatch in argument ‘ch’ at (1); passed COMPLEX(8) to REAL(8)
…/…/src/fftlib/cfftnd.f90:581:72:
581 | call cmf4kf ( lot, ido, l1, na, c, jump, inc, ch, 1, lot, wa(iw) )
| 1
Error: Type mismatch in argument ‘cc’ at (1); passed COMPLEX(8) to REAL(8)
…/…/src/fftlib/cfftnd.f90:583:72:
583 | call cmf4kf ( lot, ido, l1, na, ch, 1, lot, c, jump, inc, wa(iw) )
| 1
Error: Type mismatch in argument ‘ch’ at (1); passed COMPLEX(8) to REAL(8)
…/…/src/fftlib/cfftnd.f90:585:72:
585 | call cmf5kf ( lot, ido, l1, na, c, jump, inc, ch, 1, lot, wa(iw) )
| 1
Error: Type mismatch in argument ‘cc’ at (1); passed COMPLEX(8) to REAL(8)
…/…/src/fftlib/cfftnd.f90:587:72:
587 | call cmf5kf ( lot, ido, l1, na, ch, 1, lot, c, jump, inc, wa(iw) )
| 1
Error: Type mismatch in argument ‘ch’ at (1); passed COMPLEX(8) to REAL(8)
…/…/src/fftlib/cfftnd.f90:590:24:
590 | 1, lot, wa(iw) )
| 1
Error: Type mismatch in argument ‘cc’ at (1); passed COMPLEX(8) to REAL(8)
…/…/src/fftlib/cfftnd.f90:593:27:
593 | jump, inc, wa(iw) )
| 1
Error: Type mismatch in argument ‘ch’ at (1); passed COMPLEX(8) to REAL(8)
…/…/src/fftlib/cfftnd.f90:470:72:
470 | call cmf2kb ( lot, ido, l1, na, c, jump, inc, ch, 1, lot, wa(iw) )
| 1
Error: Type mismatch in argument ‘cc’ at (1); passed COMPLEX(8) to REAL(8)
…/…/src/fftlib/cfftnd.f90:472:72:
472 | call cmf2kb ( lot, ido, l1, na, ch, 1, lot, c, jump, inc, wa(iw) )
| 1
Error: Type mismatch in argument ‘ch’ at (1); passed COMPLEX(8) to REAL(8)
…/…/src/fftlib/cfftnd.f90:474:72:
474 | call cmf3kb ( lot, ido, l1, na, c, jump, inc, ch, 1, lot, wa(iw) )
| 1
Error: Type mismatch in argument ‘cc’ at (1); passed COMPLEX(8) to REAL(8)
…/…/src/fftlib/cfftnd.f90:476:72:
476 | call cmf3kb ( lot, ido, l1, na, ch, 1, lot, c, jump, inc, wa(iw) )
| 1
Error: Type mismatch in argument ‘ch’ at (1); passed COMPLEX(8) to REAL(8)
…/…/src/fftlib/cfftnd.f90:478:72:
478 | call cmf4kb ( lot, ido, l1, na, c, jump, inc, ch, 1, lot, wa(iw) )
| 1
Error: Type mismatch in argument ‘cc’ at (1); passed COMPLEX(8) to REAL(8)
…/…/src/fftlib/cfftnd.f90:480:72:
480 | call cmf4kb ( lot, ido, l1, na, ch, 1, lot, c, jump, inc, wa(iw) )
| 1
Error: Type mismatch in argument ‘ch’ at (1); passed COMPLEX(8) to REAL(8)
…/…/src/fftlib/cfftnd.f90:482:72:
482 | call cmf5kb ( lot, ido, l1, na, c, jump, inc, ch, 1, lot, wa(iw) )
| 1
Error: Type mismatch in argument ‘cc’ at (1); passed COMPLEX(8) to REAL(8)
…/…/src/fftlib/cfftnd.f90:484:72:
484 | call cmf5kb ( lot, ido, l1, na, ch, 1, lot, c, jump, inc, wa(iw) )
| 1
Error: Type mismatch in argument ‘ch’ at (1); passed COMPLEX(8) to REAL(8)
…/…/src/fftlib/cfftnd.f90:487:24:
487 | 1, lot, wa(iw) )
| 1
Error: Type mismatch in argument ‘cc’ at (1); passed COMPLEX(8) to REAL(8)
…/…/src/fftlib/cfftnd.f90:490:27:
490 | jump, inc, wa(iw) )
| 1
Error: Type mismatch in argument ‘ch’ at (1); passed COMPLEX(8) to REAL(8)
make[3]: *** [Makefile.fft:10: cfftnd.o] Error 1
make[3]: Leaving directory ‘/home/tutorials/exciting/build/serial’
make[2]: *** […/Make.common:159: fftlib.a] Error 2
make[2]: Leaving directory ‘/home/tutorials/exciting/build/serial’
make[1]: *** [Makefile:3: all] Error 2
make[1]: Leaving directory ‘/home/tutorials/exciting/build/serial’
make: *** [Makefile:20: serial] Error 2
The make.inc files is :
F90 = gfortran
F90_OPTS = -O3 -march=native -ffree-line-length-0
CPP_ON_OPTS = -cpp -DXS -DISO -DLIBXC
F77 = $(F90)
F77_OPTS = -O3
Required for compilation of LibXC
FCCPP = cpp
F90_DEBUGOPTS = -g -O0 -DUSE_ASSERT -fbounds-check -fbacktrace -Wall -Wextra -ffree-line-length-0 -fcheck=all -finit-integer=2147483647 -finit-real=snan
-frecord-gcc-switches -finit-character=42 -finit-logical=true -ffpe-trap=invalid,zero,overflow -fdump-core -fstack-protector-all -pipe
Unusable debug flags: -pedantic
F77_DEBUGOPTS = $(F90_DEBUGOPTS)
If compiling on mac, one may need to specify the location of the openMP header file.
For example, if using Macports it may look like:
INCL = -I/opt/local/lib/gcc10/gcc/x86_64-apple-darwin19/10.2.0/finclude/
INCL =
Libaries
LIB_ARP = libarpack.a
Use native blas/lapack by default
export USE_SYS_LAPACK=true
LIB_LPK = -L./ -llapack -lblas
LIB_FFT = fftlib.a
LIB_BZINT = libbzint.a
LIBS = (LIB_ARP) (LIB_LPK) (LIB_FFT) (LIB_BZINT)
SMP and MPI compilers, flags and preprocessing variables
MPIF90 = mpif90
MPIF90_OPTS = -DMPI
MPI_LIBS =
To use Scalapack, include the preprocessing variable, provide the library path and library name
#MPIF90_OPTS = -DMPI -DSCAL
#MPI_LIBS = -L/opt/local/lib/ -lscalapack
SMPF90_OPTS = -fopenmp -DUSEOMP
SMPF77_OPTS = $(SMPF90_OPTS)
SMP_LIBS =
BUILDMPI = true
BUILDSMP = true
BUILDMPISMP = true
Any help with the compilation will be highly appreciated.
Regards,
Paritosh Singh