dda

AMD Ryzen Threadripper PRO 5965WX 24-Cores testing with a ASUS Pro WS WRX80E-SAGE SE WIFI (1201 BIOS) and ASUS NVIDIA NV106 2GB on Ubuntu 23.10 via the Phoronix Test Suite.

Compare your own system(s) to this result file with the Phoronix Test Suite by running the command: phoronix-test-suite benchmark 2311109-NE-DDA03205699
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BLAS (Basic Linear Algebra Sub-Routine) Tests 2 Tests
Fortran Tests 2 Tests
HPC - High Performance Computing 4 Tests
LAPACK (Linear Algebra Pack) Tests 2 Tests
Molecular Dynamics 3 Tests
Multi-Core 2 Tests
OpenMPI Tests 3 Tests
Scientific Computing 3 Tests

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November 10 2023
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November 10 2023
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ddaOpenBenchmarking.orgPhoronix Test SuiteAMD Ryzen Threadripper PRO 5965WX 24-Cores @ 3.80GHz (24 Cores / 48 Threads)ASUS Pro WS WRX80E-SAGE SE WIFI (1201 BIOS)AMD Starship/Matisse8 x 16 GB DDR4-2133MT/s Corsair CMK32GX4M2E3200C162048GB SOLIDIGM SSDPFKKW020X7ASUS NVIDIA NV106 2GBAMD Starship/MatisseVA24312 x Intel X550 + Intel Wi-Fi 6 AX200Ubuntu 23.106.5.0-10-generic (x86_64)GNOME Shell 45.0X Servernouveau4.3 Mesa 23.2.1-1ubuntu3GCC 13.2.0ext41920x1080ProcessorMotherboardChipsetMemoryDiskGraphicsAudioMonitorNetworkOSKernelDesktopDisplay ServerDisplay DriverOpenGLCompilerFile-SystemScreen ResolutionDda BenchmarksSystem Logs- Transparent Huge Pages: madvise- --build=x86_64-linux-gnu --disable-vtable-verify --disable-werror --enable-bootstrap --enable-cet --enable-checking=release --enable-clocale=gnu --enable-default-pie --enable-gnu-unique-object --enable-languages=c,ada,c++,go,d,fortran,objc,obj-c++,m2 --enable-libphobos-checking=release --enable-libstdcxx-debug --enable-libstdcxx-time=yes --enable-link-serialization=2 --enable-multiarch --enable-multilib --enable-nls --enable-objc-gc=auto --enable-offload-defaulted --enable-offload-targets=nvptx-none=/build/gcc-13-XYspKM/gcc-13-13.2.0/debian/tmp-nvptx/usr,amdgcn-amdhsa=/build/gcc-13-XYspKM/gcc-13-13.2.0/debian/tmp-gcn/usr --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-build-config=bootstrap-lto-lean --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 - Scaling Governor: acpi-cpufreq schedutil (Boost: Enabled) - CPU Microcode: 0xa008205- gather_data_sampling: Not affected + itlb_multihit: Not affected + l1tf: Not affected + mds: Not affected + meltdown: Not affected + mmio_stale_data: Not affected + retbleed: Not affected + spec_rstack_overflow: Mitigation of safe RET no microcode + spec_store_bypass: Mitigation of SSB disabled via prctl + spectre_v1: Mitigation of usercopy/swapgs barriers and __user pointer sanitization + spectre_v2: Mitigation of Retpolines IBPB: conditional IBRS_FW STIBP: always-on RSB filling PBRSB-eIBRS: Not affected + srbds: Not affected + tsx_async_abort: Not affected

ddagromacs: MPI CPU - water_GMX50_barenamd: ATPase Simulation - 327,506 Atomsnwchem: C240 Buckyballwrf: conus 2.5kmab3.2953.117433531.326714.4043.2683.178543569.726845.847OpenBenchmarking.org

GROMACS

The GROMACS (GROningen MAchine for Chemical Simulations) molecular dynamics package testing with the water_GMX50 data. This test profile allows selecting between CPU and GPU-based GROMACS builds. Learn more via the OpenBenchmarking.org test page.

OpenBenchmarking.orgNs Per Day, More Is BetterGROMACS 2023Implementation: MPI CPU - Input: water_GMX50_bareba0.74141.48282.22422.96563.707SE +/- 0.013, N = 3SE +/- 0.036, N = 33.2683.2951. (CXX) g++ options: -O3

NAMD

NAMD is a parallel molecular dynamics code designed for high-performance simulation of large biomolecular systems. NAMD was developed by the Theoretical and Computational Biophysics Group in the Beckman Institute for Advanced Science and Technology at the University of Illinois at Urbana-Champaign. Learn more via the OpenBenchmarking.org test page.

OpenBenchmarking.orgdays/ns, Fewer Is BetterNAMD 2.14ATPase Simulation - 327,506 Atomsba0.71521.43042.14562.86083.576SE +/- 0.08460, N = 12SE +/- 0.11648, N = 93.178543.11743

NWChem

NWChem is an open-source high performance computational chemistry package. Per NWChem's documentation, "NWChem aims to provide its users with computational chemistry tools that are scalable both in their ability to treat large scientific computational chemistry problems efficiently, and in their use of available parallel computing resources from high-performance parallel supercomputers to conventional workstation clusters." Learn more via the OpenBenchmarking.org test page.

OpenBenchmarking.orgSeconds, Fewer Is BetterNWChem 7.0.2Input: C240 Buckyballba80016002400320040003569.73531.31. (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 -lopen-rte -lopen-pal -lhwloc -levent_core -levent_pthreads -lm -lz -lcomex -m64 -ffast-math -std=legacy -fdefault-integer-8 -finline-functions -O2

WRF

WRF, the Weather Research and Forecasting Model, is a "next-generation mesoscale numerical weather prediction system designed for both atmospheric research and operational forecasting applications. It features two dynamical cores, a data assimilation system, and a software architecture supporting parallel computation and system extensibility." Learn more via the OpenBenchmarking.org test page.

OpenBenchmarking.orgSeconds, Fewer Is BetterWRF 4.2.2Input: conus 2.5kmba6K12K18K24K30K26845.8526714.401. (F9X) gfortran options: -O2 -ftree-vectorize -funroll-loops -ffree-form -fconvert=big-endian -frecord-marker=4 -fallow-invalid-boz -lesmf_time -lwrfio_nf -lnetcdff -lnetcdf -lmpi_usempif08 -lmpi_mpifh -lmpi -lopen-rte -lopen-pal -lhwloc -levent_core -levent_pthreads -lm -lz