Match comparison for Hartree energy (match type 30627)

Commits > Commit d89ed1adec8f63937926022ba961c15ddb98b66b > Input 22-vdw_d3_stress.01-Be_hpc.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
2.826117060000000e+00 1.410000000000000e-07 2.826116999090909e+00 3.579094487627840e-08 2.826117065000000e+00 7.499999998827889e-08 PASS

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Detailed information

Reference: 2.82611706, precision: 0.000000141
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-full] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-min] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss-ppc: [foss2022a-serial] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
intel_omp_autotools: [intel2022a-serial] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss-serial-min: [foss2022a-serial] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss-serial-min: [foss2023a-serial] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
intel_omp_autotools: [intel2023a-serial] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss-serial-full: [foss2023a-serial] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss-serial-full: [foss2023b-serial] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss-serial-min: [foss2023b-serial] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss-serial-debug: [foss2023a-serial] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss-opt-full: [foss2023a-serial] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss-omp-full: [foss2023a-serial] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
intel-serial: [intel2023a-serial] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss-mpi-full: [foss2023a-mpi] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss-mpi-min: [foss2022a-mpi] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss-mpi-min: [foss2023a-mpi] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss-mpi-debug: [foss2023a-mpi] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
valgrind: [foss2023a-serial] 2.826116990000000e+00 -7.000000001866624e-08 -4.964539008416045e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 2.826117140000000e+00 7.999999995789153e-08 5.673758862261811e-01 PASS
cuda-serial: [foss2022a-cuda-mpi] 2.826117140000000e+00 7.999999995789153e-08 5.673758862261811e-01 PASS