Merge pull request #1102 from caic99/docker

Build: update intel image to ubuntu 22.04

Author: caic99

Dockerfile.intel

@@ -1,6 +1,8 @@
-FROM debian:bullseye-slim
+FROM ubuntu:22.04
 
-RUN apt-get update && apt-get install -y bc cmake git gnupg gcc g++ python3 sudo wget vim unzip
+RUN apt-get update && apt-get install -y \
+    bc cmake git gnupg gcc g++ python3-numpy sudo wget vim unzip \
+    libcereal-dev libxc-dev libgtest-dev libgmock-dev
 
 # Following steps by https://software.intel.com/content/www/us/en/develop/documentation/installation-guide-for-intel-oneapi-toolkits-linux/top/installation/install-using-package-managers/apt.html .
 RUN cd /tmp && \
@@ -11,20 +13,22 @@ RUN cd /tmp && \
 
 # To save disk space, only install the required components, but not the whole intel-hpckit.
 RUN apt-get update --allow-unauthenticated \
-	&& apt-get install -y  \
+	&& apt-get install -y --no-install-recommends \
 		intel-oneapi-compiler-dpcpp-cpp-and-cpp-classic \
 		intel-oneapi-compiler-fortran \
 		intel-oneapi-mkl-devel \
 		intel-oneapi-mpi-devel
 
 # These environment variables are the most essential part generated by `source /opt/intel/oneapi/setvars.sh`.
 # It is recommended to do it again if this docker image is used for development.
-ENV I_MPI_ROOT=/opt/intel/oneapi/mpi/latest \
+ENV I_MPI_ROOT='/opt/intel/oneapi/mpi/latest' \
 	LIBRARY_PATH=/opt/intel/oneapi/tbb/latest/env/../lib/intel64/gcc4.8:/opt/intel/oneapi/mpi/latest//libfabric/lib:/opt/intel/oneapi/mpi/latest//lib/release:/opt/intel/oneapi/mpi/latest//lib:/opt/intel/oneapi/mkl/latest/lib/intel64:/opt/intel/oneapi/compiler/latest/linux/compiler/lib/intel64_lin:/opt/intel/oneapi/compiler/latest/linux/lib \
 	LD_LIBRARY_PATH=/opt/intel/oneapi/tbb/latest/env/../lib/intel64/gcc4.8:/opt/intel/oneapi/mpi/latest//libfabric/lib:/opt/intel/oneapi/mpi/latest//lib/release:/opt/intel/oneapi/mpi/latest//lib:/opt/intel/oneapi/mkl/latest/lib/intel64:/opt/intel/oneapi/debugger/10.1.2/gdb/intel64/lib:/opt/intel/oneapi/debugger/10.1.2/libipt/intel64/lib:/opt/intel/oneapi/debugger/10.1.2/dep/lib:/opt/intel/oneapi/compiler/latest/linux/lib:/opt/intel/oneapi/compiler/latest/linux/lib/x64:/opt/intel/oneapi/compiler/latest/linux/lib/emu:/opt/intel/oneapi/compiler/latest/linux/compiler/lib/intel64_lin \
 	PATH=/opt/intel/oneapi/mpi/latest//libfabric/bin:/opt/intel/oneapi/mpi/latest//bin:/opt/intel/oneapi/mkl/latest/bin/intel64:/opt/intel/oneapi/dev-utilities/latest/bin:/opt/intel/oneapi/debugger/10.1.2/gdb/intel64/bin:/opt/intel/oneapi/compiler/latest/linux/bin/intel64:/opt/intel/oneapi/compiler/latest/linux/bin:/usr/local/sbin:/usr/local/bin:/usr/sbin:/usr/bin:/sbin:/bin \
-	MKLROOT=/opt/intel/oneapi/mkl/latest \
-	I_MPI_ROOT=/opt/intel/oneapi/mpi/latest
+	MKLROOT='/opt/intel/oneapi/mkl/latest' \
+    FI_PROVIDER_PATH='/opt/intel/oneapi/mpi/latest/libfabric/lib/prov:/usr/lib64/libfabric' \
+    CMAKE_PREFIX_PATH='/opt/intel/oneapi/vpl/latest:/opt/intel/oneapi/tbb/latest/env/..:/opt/intel/oneapi/dnnl/latest/cpu_dpcpp_gpu_dpcpp/../lib/cmake:/opt/intel/oneapi/dal/latest:/opt/intel/oneapi/compiler/latest/linux/IntelDPCPP' \
+    CMPLR_ROOT='/opt/intel/oneapi/compiler/latest'
 
 # Using the Intel Compilers with mpi wrapper.
 # Further test on oneAPI Compilers needed: icx, icpx, ifx
@@ -39,12 +43,7 @@ RUN source /opt/intel/oneapi/setvars.sh \
 	&& tar xzf elpa-2021.05.002.tar.gz  && rm elpa-2021.05.002.tar.gz \
 	&& cd elpa-2021.05.002 && mkdir build && cd build \
 	&& ../configure FCFLAGS="-qmkl=cluster" \
-	&& make -j8 \
+	&& make -j`nproc` \
 	&& make PREFIX=/usr/local install \
 	&& ln -s /usr/local/include/elpa-2021.05.002/elpa /usr/local/include/ \
 	&& cd /tmp && rm -rf elpa-2021.05.002
-
-RUN cd /tmp \
-	&& git clone https://github.com/USCiLab/cereal.git \
-	&& cp -r cereal/include /usr/local \
-	&& rm -rf cereal