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</o:shapelayout></xml><![endif]--></head><body lang=KO link="#0563C1" vlink="#954F72"><div class=WordSection1><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>Hi all,<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>I am new to QE. I am trying to install QE with GPU. I installed nvidia hpc_sdk v.24.5 for this on<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>/opt/nvidia/hpc_sdk/Linux_x86_64/24.5<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>My gpu is Geforce RTX 3080 (Ampere architecture I suppose).<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'><o:p> </o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>After successful (?) configure command, I made "make all" and I got following error.<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>To me, it seems nvcc compiler doesn’t take '-gpu=cc80,cuda12.4' option. <o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'><o:p> </o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>In fact,<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>$ which nvcc<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>/opt/nvidia/hpc_sdk/Linux_x86_64/2024/cuda/12.4/bin/nvcc<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>$ nvcc -gpu=cc80,cuda12.4<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>nvcc fatal : Unknown option '-gpu=cc80,cuda12.4'<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'><o:p> </o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>I might be wrong though.<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'><o:p> </o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>Any advice or help will be greatly apprecited.<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>Thank you very much in advance.<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>SJ<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'><o:p> </o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>$make all<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>make[1]: Entering directory `/home/sjang/install/qe-7.3.1/UtilXlib'<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>/opt/nvidia/hpc_sdk/Linux_x86_64/24.5/comm_libs/12.4/openmpi4/openmpi-4.1.5/bin/mpif90 -fast -Mcache_align -Mpreprocess -Mlarge_arrays -D__PGI -D__CUDA -D__DFTI -D__MPI -D__SCALAPACK -cuda -gpu=cc80,cuda12.4 -I/home/sjang/install/qe-7.3.1//external/devxlib/src -I/home/sjang/install/qe-7.3.1//external/devxlib/include -acc -I/home/sjang/install/qe-7.3.1//external/devxlib/src -I. -I/home/sjang/install/qe-7.3.1//include -I/usr/local/intel/compilers_and_libraries_2020.4.304/linux/mkl/include -I. -c parallel_include.f90<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>/opt/nvidia/hpc_sdk/Linux_x86_64/24.5/comm_libs/12.4/openmpi4/openmpi-4.1.5/bin/mpif90 -fast -Mcache_align -Mpreprocess -Mlarge_arrays -D__PGI -D__CUDA -D__DFTI -D__MPI -D__SCALAPACK -cuda -gpu=cc80,cuda12.4 -I/home/sjang/install/qe-7.3.1//external/devxlib/src -I/home/sjang/install/qe-7.3.1//external/devxlib/include -acc -I/home/sjang/install/qe-7.3.1//external/devxlib/src -I. -I/home/sjang/install/qe-7.3.1//include -I/usr/local/intel/compilers_and_libraries_2020.4.304/linux/mkl/include -I. -c util_param.f90<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>/opt/nvidia/hpc_sdk/Linux_x86_64/24.5/comm_libs/12.4/openmpi4/openmpi-4.1.5/bin/mpif90 -fast -Mcache_align -Mpreprocess -Mlarge_arrays -D__PGI -D__CUDA -D__DFTI -D__MPI -D__SCALAPACK -cuda -gpu=cc80,cuda12.4 -I/home/sjang/install/qe-7.3.1//external/devxlib/src -I/home/sjang/install/qe-7.3.1//external/devxlib/include -acc -I/home/sjang/install/qe-7.3.1//external/devxlib/src -I. -I/home/sjang/install/qe-7.3.1//include -I/usr/local/intel/compilers_and_libraries_2020.4.304/linux/mkl/include -I. -c clib_wrappers.f90<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>/opt/nvidia/hpc_sdk/Linux_x86_64/24.5/comm_libs/12.4/openmpi4/openmpi-4.1.5/bin/mpif90 -fast -Mcache_align -Mpreprocess -Mlarge_arrays -D__PGI -D__CUDA -D__DFTI -D__MPI -D__SCALAPACK -cuda -gpu=cc80,cuda12.4 -I/home/sjang/install/qe-7.3.1//external/devxlib/src -I/home/sjang/install/qe-7.3.1//external/devxlib/include -acc -I/home/sjang/install/qe-7.3.1//external/devxlib/src -I. -I/home/sjang/install/qe-7.3.1//include -I/usr/local/intel/compilers_and_libraries_2020.4.304/linux/mkl/include -I. -c nvtx_wrapper.f90<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>/opt/nvidia/hpc_sdk/Linux_x86_64/24.5/comm_libs/12.4/openmpi4/openmpi-4.1.5/bin/mpif90 -fast -Mcache_align -Mpreprocess -Mlarge_arrays -D__PGI -D__CUDA -D__DFTI -D__MPI -D__SCALAPACK -cuda -gpu=cc80,cuda12.4 -I/home/sjang/install/qe-7.3.1//external/devxlib/src -I/home/sjang/install/qe-7.3.1//external/devxlib/include -acc -I/home/sjang/install/qe-7.3.1//external/devxlib/src -I. -I/home/sjang/install/qe-7.3.1//include -I/usr/local/intel/compilers_and_libraries_2020.4.304/linux/mkl/include -I. -c clocks_handler.f90<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>nvcc -O3 -D__PGI -D__CUDA -D__DFTI -D__MPI -D__SCALAPACK -I. -I/home/sjang/install/qe-7.3.1//include -I/usr/local/intel/compilers_and_libraries_2020.4.304/linux/mkl/include -gpu=cc80,cuda12.4 -acc -c cptimer.c<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>nvcc fatal : Unknown option '-gpu=cc80,cuda12.4'<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>make[1]: *** [cptimer.o] Error 1<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>make[1]: Leaving directory `/home/sjang/install/qe-7.3.1/UtilXlib'<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>make: *** [libutil] Error 1<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'><o:p> </o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>--------------------------------------------------------------------------------------------------<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>Before ‘make all’ command, this is my configure command and resulting log<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'><o:p> </o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>$echo $NVHPC_CUDA_HOME<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>/opt/nvidia/hpc_sdk/Linux_x86_64/2024/cuda/12.4<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'><o:p> </o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>$./configure F90=nvfortran MPIF90=/opt/nvidia/hpc_sdk/Linux_x86_64/24.5/comm_libs/12.4/openmpi4/openmpi-4.1.5/bin/mpif90 CC=nvcc CXX=nvc++ --with-cuda=$NVHPC_CUDA_HOME --prefix=$HOME/QE --with-cuda-cc=80 --with-cuda-runtime=12.4<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'><o:p> </o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>….<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>….<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>all dependencies updated successfully<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking build system type... x86_64-pc-linux-gnu<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking ARCH... x86_64<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking setting AR... ... ar<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking setting ARFLAGS... ... ruv<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking whether the Fortran compiler works... yes<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking for Fortran compiler default output file name... a.out<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking for suffix of executables...<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking whether we are cross compiling... no<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking for suffix of object files... o<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking whether we are using the GNU Fortran compiler... no<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking whether /opt/nvidia/hpc_sdk/Linux_x86_64/24.5/compilers/bin/nvfortran accepts -g... yes<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking for Fortran flag to compile .f90 files... none<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking for /opt/nvidia/hpc_sdk/Linux_x86_64/24.5/comm_libs/12.4/openmpi4/openmpi-4.1.5/bin/mpif90... no<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking whether we are using the GNU Fortran compiler... no<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking whether accepts -g... no<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>configure: WARNING: MPIF90 not found: using MPIF90 anyway<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking version of /opt/nvidia/hpc_sdk/Linux_x86_64/24.5/comm_libs/12.4/openmpi4/openmpi-4.1.5/bin/mpif90... nvfortran 24.5-1<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>configure: WARNING: Check whether user-supplied F90 is consistent with MPIF90 !!!<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>setting F90... nvfortran<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>setting MPIF90... /opt/nvidia/hpc_sdk/Linux_x86_64/24.5/comm_libs/12.4/openmpi4/openmpi-4.1.5/bin/mpif90<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking whether we are using the GNU C compiler... yes<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking whether nvcc accepts -g... yes<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking for nvcc option to accept ISO C89... none needed<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>setting CC... nvcc<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>setting CFLAGS... -O3<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>using F90... nvfortran<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>setting FFLAGS... -fast<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>setting F90FLAGS... -fast -Mcache_align -Mpreprocess -Mlarge_arrays<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>setting FFLAGS_NOOPT... -O0<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>setting FFLAGS_NOMAIN... -Mnomain<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>setting CPP... cpp<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>setting CPPFLAGS... -P -traditional -Uvector<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>setting LD... /opt/nvidia/hpc_sdk/Linux_x86_64/24.5/comm_libs/12.4/openmpi4/openmpi-4.1.5/bin/mpif90<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>setting LDFLAGS...<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking whether Fortran compiler accepts -cuda -gpu=cuda12.4... yes<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking whether make sets $(MAKE)... yes<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking whether Fortran files must be preprocessed... no<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking for library containing dgemm... -lmkl_intel_lp64<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>setting BLAS_LIBS... -lmkl_intel_lp64 -lmkl_sequential -lmkl_core<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking FFT...<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking MASS...<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking for library containing mpi_init... none required<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking for library containing pdgemr2d... no<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking for library containing pdgemr2d... -lmkl_scalapack_lp64<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking ELPA...<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking for Environ... not used<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking if legacy plugins are enabled ... no<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking for ranlib... ranlib<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking for wget... wget -O<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>setting WGET... wget -O<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>checking for git... git<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>setting DFLAGS... -D__PGI -D__CUDA -D__DFTI -D__MPI -D__SCALAPACK<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>setting IFLAGS... -I. -I$(TOPDIR)/include -I/usr/local/intel/compilers_and_libraries_2020.4.304/linux/mkl/include<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>configure: creating ./config.status<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>config.status: creating install/make_lapack.inc<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>config.status: creating include/configure.h<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>config.status: creating make.inc<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>config.status: creating configure.msg<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>config.status: creating install/make_wannier90.inc<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>--------------------------------------------------------------------<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>ESPRESSO can take advantage of several optimized numerical libraries<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>(essl, fftw, mkl...). This configure script attempts to find them,<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>but may fail if they have been installed in non-standard locations.<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>If a required library is not found, the local copy will be compiled.<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'><o:p> </o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>The following libraries have been found:<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'> BLAS_LIBS= -lmkl_intel_lp64 -lmkl_sequential -lmkl_core<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'> LAPACK_LIBS=<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'> SCALAPACK_LIBS=-lmkl_scalapack_lp64 -lmkl_blacs_openmpi_lp64<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'> FFT_LIBS=<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'> <o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>Please check if this is what you expect.<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'><o:p> </o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>If any libraries are missing, you may specify a list of directories<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>to search and retry, as follows:<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'> ./configure LIBDIRS="list of directories, separated by spaces"<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'><o:p> </o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>Parallel environment detected successfully.\<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>Configured for compilation of parallel executables.<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'><o:p> </o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>For more info, read the ESPRESSO User's Guide (Doc/users-guide.tex).<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>--------------------------------------------------------------------<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>configure: success<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'><o:p> </o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'><o:p> </o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>--------------------------------------------------------------------------------------------------<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>Here is my PATH info<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'><o:p> </o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>echo $PATH<br>/opt/nvidia/hpc_sdk/Linux_x86_64/24.5/compilers/extras/qd/bin:/opt/nvidia/hpc_sdk/Linux_x86_64/24.5/cuda/bin:/opt/nvidia/hpc_sdk/Linux_x86_64/2024/cuda/12.4/bin:/opt/nvidia/hpc_sdk/Linux_x86_64/24.5/comm_libs/mpi/bin:/opt/nvidia/hpc_sdk/Linux_x86_64/24.5/compilers/bin:/home/sjang/software/xdrfile/bin:/home/sjang/software/plumed272_intel/bin:/usr/local/mpi/intel19/openmpi-3.1.6/bin:/home/sjang/software/GMX2021_plumed272_intel/bin:/home/sjang/vmd/bin:/home/sjang/software/packmol:/home/sjang/software/rosetta_src_2021.16.61629_bundle/main/source/bin:/home/sjang/g16/g16/bsd:/home/sjang/g16/g16:/usr/local/intel/compilers_and_libraries_2020.4.304/linux/bin/intel64:/usr/local/intel/compilers_and_libraries_2020.4.304/linux/bin:/usr/local/intel/compilers_and_libraries_2020.4.304/linux/mpi/intel64/libfabric/bin:/usr/local/intel/compilers_and_libraries_2020.4.304/linux/mpi/intel64/bin:/usr/local/intel/debugger_2020/gdb/intel64/bin:/opt/rh/devtoolset-9/root/usr/bin:/usr/local/anaconda/3/2021.05/bin:/usr/local/anaconda/3/2021.05/condabin:/opt/nvidia/hpc_sdk/Linux_x86_64/2024/cuda/12.4/bin:/usr/lib64/qt-3.3/bin:/usr/torque/sbin:/usr/torque/bin:/opt/pbs/sbin:/opt/pbs/bin:/usr/local/jspcmds:.:/home/my_uer_name:/usr/local/bin:/usr/bin:/usr/local/sbin:/usr/sbin:/opt/dell/srvadmin/bin<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'><o:p> </o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'><o:p> </o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>--------------------------------------------------------------------------------------------------<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>Here is my LD_LIBRARY_PATH info<o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'><o:p> </o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>echo $LD_LIBRARY_PATH <o:p></o:p></span></p><p class=MsoNormal align=left style='text-align:left;text-autospace:ideograph-other;vertical-align:baseline;word-break:keep-all'><span lang=EN-US style='font-size:12.0pt;font-family:"Calibri",sans-serif;color:black'>/opt/nvidia/hpc_sdk/Linux_x86_64/24.5/comm_libs/nvshmem/lib:/opt/nvidia/hpc_sdk/Linux_x86_64/24.5/comm_libs/nccl/lib:/opt/nvidia/hpc_sdk/Linux_x86_64/24.5/math_libs/lib64:/opt/nvidia/hpc_sdk/Linux_x86_64/24.5/compilers/lib:/opt/nvidia/hpc_sdk/Linux_x86_64/24.5/compilers/extras/qd/lib:/opt/nvidia/hpc_sdk/Linux_x86_64/24.5/cuda/extras/CUPTI/lib64:/opt/nvidia/hpc_sdk/Linux_x86_64/24.5/cuda/lib64:/opt/nvidia/hpc_sdk/Linux_x86_64/2024/cuda/12.4/extras/CUPTI/lib64:/opt/nvidia/hpc_sdk/Linux_x86_64/2024/cuda/12.4/lib64:/opt/nvidia/hpc_sdk/Linux_x86_64/24.5/math_libs:/usr/local/lib:/home/sjang/software/xdrfile/lib:/home/sjang/software/plumed272_intel/lib:/usr/local/mpi/intel19/openmpi-3.1.6/lib:/usr/local/intel/compilers_and_libraries_2020.4.304/linux/compiler/lib/intel64_lin:/usr/local/intel/compilers_and_libraries_2020.4.304/linux/mpi/intel64/libfabric/lib:/usr/local/intel/compilers_and_libraries_2020.4.304/linux/mpi/intel64/lib/release:/usr/local/intel/compilers_and_libraries_2020.4.304/linux/mpi/intel64/lib:/usr/local/intel/compilers_and_libraries_2020.4.304/linux/ipp/lib/intel64:/usr/local/intel/compilers_and_libraries_2020.4.304/linux/mkl/lib/intel64_lin:/usr/local/intel/compilers_and_libraries_2020.4.304/linux/tbb/lib/intel64/gcc4.8:/usr/local/intel/debugger_2020/python/intel64/lib:/usr/local/intel/debugger_2020/libipt/intel64/lib:/usr/local/intel/compilers_and_libraries_2020.4.304/linux/daal/lib/intel64_lin:/usr/local/intel/compilers_and_libraries_2020.4.304/linux/daal/../tbb/lib/intel64_lin/gcc4.4:/usr/local/intel/compilers_and_libraries_2020.4.304/linux/daal/../tbb/lib/intel64_lin/gcc4.8:/opt/rh/devtoolset-9/root/usr/lib64:/opt/rh/devtoolset-9/root/usr/lib:/opt/rh/devtoolset-9/root/usr/lib64/dyninst:/opt/rh/devtoolset-9/root/usr/lib/dyninst:/opt/nvidia/hpc_sdk/Linux_x86_64/2024/cuda/12.4/extras/CUPTI/lib64:/opt/nvidia/hpc_sdk/Linux_x86_64/2024/cuda/12.4/lib64:/home/sjang/g16/gv/lib<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US><o:p> </o:p></span></p><p class=MsoNormal><span lang=EN-US><o:p> </o:p></span></p></div></body></html>