nwchem icelake 2 x Intel Xeon Platinum 8380 testing with a Intel M50CYP2SB2U (SE5C6200.86B.0022.D08.2103221623 BIOS) and ASPEED on Ubuntu 20.04 via the Phoronix Test Suite.
HTML result view exported from: https://openbenchmarking.org/result/2105023-IB-NWCHEMICE98 .
nwchem icelake Processor Motherboard Chipset Memory Disk Graphics Network OS Kernel Desktop Display Server Compiler File-System Screen Resolution 1 2 2 x Intel Xeon Platinum 8380 @ 3.40GHz (80 Cores / 160 Threads) Intel M50CYP2SB2U (SE5C6200.86B.0022.D08.2103221623 BIOS) Intel Device 0998 16 x 32 GB DDR4-3200MT/s Hynix HMA84GR7CJR4N-XN 2 x 7682GB INTEL SSDPF2KX076TZ + 2 x 800GB INTEL SSDPF21Q800GB + 3841GB Micron_9300_MTFDHAL3T8TDP + 960GB INTEL SSDSC2KG96 ASPEED 2 x Intel X710 for 10GBASE-T + 2 x Intel E810-C for QSFP Ubuntu 20.04 5.11.0-051100-generic (x86_64) GNOME Shell 3.36.4 X Server 1.20.8 GCC 9.3.0 ext4 1024x768 OpenBenchmarking.org Kernel Details - Transparent Huge Pages: madvise Compiler Details - --build=x86_64-linux-gnu --disable-vtable-verify --disable-werror --enable-checking=release --enable-clocale=gnu --enable-default-pie --enable-gnu-unique-object --enable-languages=c,ada,c++,go,brig,d,fortran,objc,obj-c++,gm2 --enable-libstdcxx-debug --enable-libstdcxx-time=yes --enable-multiarch --enable-multilib --enable-nls --enable-objc-gc=auto --enable-offload-targets=nvptx-none=/build/gcc-9-HskZEa/gcc-9-9.3.0/debian/tmp-nvptx/usr,hsa --enable-plugin --enable-shared --enable-threads=posix --host=x86_64-linux-gnu --program-prefix=x86_64-linux-gnu- --target=x86_64-linux-gnu --with-abi=m64 --with-arch-32=i686 --with-default-libstdcxx-abi=new --with-gcc-major-version-only --with-multilib-list=m32,m64,mx32 --with-target-system-zlib=auto --with-tune=generic --without-cuda-driver -v Processor Details - Scaling Governor: intel_pstate powersave - CPU Microcode: 0xd000270 Security Details - itlb_multihit: Not affected + l1tf: Not affected + mds: Not affected + meltdown: Not affected + spec_store_bypass: Mitigation of SSB disabled via prctl and seccomp + spectre_v1: Mitigation of usercopy/swapgs barriers and __user pointer sanitization + spectre_v2: Mitigation of Enhanced IBRS IBPB: conditional RSB filling + srbds: Not affected + tsx_async_abort: Not affected
nwchem icelake nwchem: C240 Buckyball Difference 1 2 1876 1.00x 1860.6 1.01x OpenBenchmarking.org
NWChem Input: C240 Buckyball OpenBenchmarking.org Seconds, Fewer Is Better NWChem 7.0.2 Input: C240 Buckyball 1 2 400 800 1200 1600 2000 1876.0 1860.6 1. (F9X) gfortran options: -lnwctask -lccsd -lmcscf -lselci -lmp2 -lmoints -lstepper -ldriver -loptim -lnwdft -lgradients -lcphf -lesp -lddscf -ldangchang -lguess -lhessian -lvib -lnwcutil -lrimp2 -lproperty -lsolvation -lnwints -lprepar -lnwmd -lnwpw -lofpw -lpaw -lpspw -lband -lnwpwlib -lcafe -lspace -lanalyze -lqhop -lpfft -ldplot -ldrdy -lvscf -lqmmm -lqmd -letrans -ltce -lbq -lmm -lcons -lperfm -ldntmc -lccca -ldimqm -lga -larmci -lpeigs -l64to32 -lopenblas -lpthread -lrt -llapack -lnwcblas -lmpi_usempif08 -lmpi_mpifh -lmpi -lcomex -lm -m64 -ffast-math -std=legacy -fdefault-integer-8 -finline-functions -O2
Phoronix Test Suite v10.8.4