[CP2K-user] ELPA compile error when install cp2k 7.1

zhijian fu jian... at gmail.com
Thu Apr 9 06:12:22 UTC 2020


Hi, I change to python2 to compile elpa 2019.05.001, but the error still 
exists:

Traceback (most recent call last):
  File "../remove_xcompiler", line 6, in <module>
    os.execvp(args[0], args[0:])
  File "/usr/lib64/python2.7/os.py", line 346, in execvp
    _execvpe(file, args)
  File "/usr/lib64/python2.7/os.py", line 370, in _execvpe
    func(file, *argrest)
OSError: [Errno 2] No such file or directory
make[1]: *** [Makefile:16610:src/libelpa_public_la-elpa_constants.lo] error 
1
在 2020年4月7日星期二 UTC+8下午4:12:54,Linfeng Gan写道:
>
> Hi, 
> Try with python 2 again?
>
> On Sunday, April 5, 2020 at 4:28:48 PM UTC+8, zhijian fu wrote:
>>
>> Hello, I want to install cp2k 7.1 using intel compiler, but when I 
>> install ELPA library, there is an error,
>> The compile setting:
>> ../configure  \
>> --prefix="/home/sunlight/work2/cp2k/libs/libelpa/201911001" \
>> --libdir="/home/sunlight/work2/cp2k/libs/libelpa/201911001/lib" \
>> --enable-openmp=no \
>> --enable-shared=no \
>> --enable-static=yes \
>> --enable-avx=yes \
>> --enable-avx2=yes \
>> --enable-avx512=yes \
>> --enable-option-checking=fatal \
>> FC=/opt/intel2020up1/compilers_and_libraries_2020.1.217/linux/mpi/intel64/bin/mpiifort 
>> \
>> CC=/opt/intel2020up1/compilers_and_libraries_2020.1.217/linux/mpi/intel64/bin/mpiicc 
>> \
>> CXX=/opt/intel2020up1/compilers_and_libraries_2020.1.217/linux/mpi/intel64/bin/mpiicpc 
>> \
>> FCFLAGS="-O3 -xAVX2" CFLAGS="-O3 -xAVX2" \
>> SCALAPACK_LDFLAGS="-L/opt/intel2020up1/mkl/lib/intel64 
>> -lmkl_scalapack_lp64 -lmkl_intel_lp64 -lmkl_sequential -lmkl_core 
>> -lmkl_blacs_intelmpi_lp64 -lpthread " \
>> SCALAPACK_FCFLAGS="-I/opt/intel2020up1/mkl/include/intel64/lp64" \
>>  >configure.log 2>&1
>>
>> The error is:
>> Traceback (most recent call last):
>>   File "../remove_xcompiler", line 6, in <module>
>>     os.execvp(args[0], args[0:])
>>   File "/opt/intel2020up1/intelpython3/lib/python3.7/os.py", line 574, in 
>> execvp
>>     _execvpe(file, args)
>>   File "/opt/intel2020up1/intelpython3/lib/python3.7/os.py", line 597, in 
>> _execvpe
>>     exec_func(file, *argrest)
>> FileNotFoundError: [Errno 2] No such file or directory
>>
>> Could you give me some advice?
>> Thank you!
>>
>
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