Open vvp-nsk opened 3 weeks ago
Just an update. There is no problem to compile v3.16.0 using the same compiler toolchain and libs.
Are you sure "mpiicc" and "mpiicpc" are GCC? They seem to be intel classic compiler. gcc 11.4 + MKL seems happy on my laptop. I guess that is an issue of an outdated compiler.
%mpiicc -show
icc -I"/software/sse2/...
%icc -V
Intel(R) C Intel(R) 64 Compiler Classic for applications running on Intel(R) 64, Version 2021.9.0 Build 20230302_000000
Copyright (C) 1985-2023 Intel Corporation. All rights reserved
%mpicxx -show
icpc -I"/software/sse2/...
%icpc -V
Intel(R) C++ Intel(R) 64 Compiler Classic for applications running on Intel(R) 64, Version 2021.9.0 Build 20230302_000000
Copyright (C) 1985-2023 Intel Corporation. All rights reserved.
Is v2023 really outdated? And yes, GCC builds v3.17.1 w/o any problem.
Best, Victor
Describe the bug Cannot compile QMCPACK v3.17.1 using Intel's compiler suite
To Reproduce
Error message
System:
modules loaded: GCC = "11.3.0", GCCcore = "11.3.0", binutils = ".2.38", ["buildenv-intel"] = "2023a-eb", ["buildtool-easybuild"] = "4.8.0-hpce082752a2", hpc = ".1.9.5", imkl = ".2023.1.0", ["imkl-FFTW"] = "2023.1.0", impi = ".2021.9.0", intel = "2023a", ["intel-compilers"] = "2023.1.0", libxml2 = "2.10.4-hpc1", ["netCDF-HDF5"] = "4.9.2-1.12.2-hpc1", zlib = ".1.2.12",
other systems where this is reproducible: I managed to reproduce the problem on two HPC clusters.