Sir, I am unable to compile libxc any 4.x ./configure FC= ifort CC=icc but they can be easily compiled with the help of autoconfiguration ./ configure with ifort and icc getting the following error configure: error: in `/home/dps/libxc-4.1.1': configure: error: C compiler cannot create executables See `config.log' for more details
Also unable to install ELPA On Sat, May 25, 2019 at 6:08 PM Gavin Abo <gs...@crimson.ua.edu> wrote: > As the error message says, the libxc library was compiled with a > different compiler. Perhaps you compiled it with gfortran (FC=gfortran). > Recompile it with ifort [ > https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg17716.html > ]. > > WIEN2k versions after 17 can use the 4.x version of libxc [ > https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg16924.html > ]. I haven't tried the latest released 4.3.4. If issues are encountered > compiling WIEN2k with it, fallback on an earlier 4.x version [ > https://tddft.org/programs/libxc/download/previous/ ]. > > It also says that it cannot find FFTW3 mpi. The fftw3 operating system > package (such as installed by apt or yum) usually only works for gfortran > and non-mpi. The FFTW can be downloaded [ > http://www.fftw.org/download.html ] and ifort compiled with --enable-mpi > [ > https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg16746.html > ]. > > > On 5/25/2019 2:55 AM, Indranil mal wrote: > > ... > I got the error > > SRC_lapw0/compile.msg:inputpars.F(6): error #7013: This module file was > not generated by any release of this compiler. [XC_F03_LIB_M] > SRC_lapw0/compile.msg:inputpars.F(17): error #6457: This derived type name > has not been declared. [XC_F03_FUNC_T] > ... > SRC_lapw0/compile.msg:/tmp/ifort1JKsyy.i(862): catastrophic error: Too > many errors, exiting > > SRC_lapw0/compile.msg:make[1]: *** [inputpars.o] Error 1 > SRC_lapw0/compile.msg:make: *** [para] Error 2 > SRC_lapw2/compile.msg:make[1]: *** [lapw2_mpi] Error 1 > SRC_lapw2/compile.msg:make: *** [rp] Error 2 > SRC_lapw2/compile.msg:make[1]: *** [lapw2c_mpi] Error 1 > SRC_lapw2/compile.msg:make: *** [cp] Error 2 > SRC_nlvdw/compile.msg:fft_modules.F(69): error #5102: Cannot open include > file 'fftw3-mpi.f03' > SRC_nlvdw/compile.msg:fft_modules.F(86): error #6404: This name does not > have a type, and must have an explicit type. [FFTW_MPI_LOCAL_SIZE_3D] > SRC_nlvdw/compile.msg:fft_modules.F(89): error #6404: This name does not > have a type, and must have an explicit type. [FFTW_ALLOC_COMPLEX] > SRC_nlvdw/compile.msg:fft_modules.F(120): error #6404: This name does not > have a type, and must have an explicit type. [FFTW_FORWARD] > SRC_nlvdw/compile.msg:fft_modules.F(121): error #6404: This name does not > have a type, and must have an explicit type. [FFTW_ESTIMATE] > SRC_nlvdw/compile.msg:fft_modules.F(117): error #6404: This name does not > have a type, and must have an explicit type. [FFTW_MPI_PLAN_DFT_3D] > SRC_nlvdw/compile.msg:fft_modules.F(125): error #6404: This name does not > have a type, and must have an explicit type. [FFTW_BACKWARD] > SRC_nlvdw/compile.msg:fft_modules.F(133): error #6601: In a CASE > statement, the case-value must be a constant expression. [FFTW_FORWARD] > SRC_nlvdw/compile.msg:fft_modules.F(133): error #6612: In a CASE > statement, the case-value must be of type INTEGER, CHARACTER, or LOGICAL. > [FFTW_FORWARD] > SRC_nlvdw/compile.msg:fft_modules.F(133): error #6611: The case-value must > be of the same type as the case-expr. [FFTW_FORWARD] > SRC_nlvdw/compile.msg:fft_modules.F(135): error #6601: In a CASE > statement, the case-value must be a constant expression. [FFTW_BACKWARD] > SRC_nlvdw/compile.msg:fft_modules.F(135): error #6612: In a CASE > statement, the case-value must be of type INTEGER, CHARACTER, or LOGICAL. > [FFTW_BACKWARD] > SRC_nlvdw/compile.msg:fft_modules.F(135): error #6611: The case-value must > be of the same type as the case-expr. [FFTW_BACKWARD] > SRC_nlvdw/compile.msg:make[1]: *** [fft_modules.o] Error 1 > SRC_nlvdw/compile.msg:make: *** [para] Error 2 > SRC_nmr/compile.msg:make[1]: *** [nmr_mpi] Error 1 > SRC_nmr/compile.msg:make: *** [rp] Error 2 > SRC_nmr/compile.msg:make[1]: *** [nmrc_mpi] Error 1 > SRC_nmr/compile.msg:make: *** [cp] Error 2 > > please help > > _______________________________________________ > Wien mailing list > Wien@zeus.theochem.tuwien.ac.at > http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien > SEARCH the MAILING-LIST at: > http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html >
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