Match comparison for Correlation energy (match type 30381)

Commits > Commit 98d0ca144537205e7b2aa0b44074de55ddb8c97d > Input 31-acetylene_b3lyp.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.387894220000000e+00 1.690000000000000e-07 -3.387894220606060e+00 2.436333489588757e-08 -3.387894240000000e+00 3.999999997894577e-08 PASS

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Detailed information

Reference: -3.38789422, precision: 0.000000169
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -3.387894200000000e+00 2.000000032253979e-08 1.183431971747917e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -3.387894200000000e+00 2.000000032253979e-08 1.183431971747917e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -3.387894240000000e+00 -1.999999987845058e-08 -1.183431945470449e-01 PASS
foss-serial-min: [foss2022a-serial] -3.387894200000000e+00 2.000000032253979e-08 1.183431971747917e-01 PASS
foss_autotools: [foss2022a-serial] -3.387894200000000e+00 2.000000032253979e-08 1.183431971747917e-01 PASS
foss_autotools: [foss2023a-serial] -3.387894200000000e+00 2.000000032253979e-08 1.183431971747917e-01 PASS
foss_autotools: [foss2023b-serial] -3.387894200000000e+00 2.000000032253979e-08 1.183431971747917e-01 PASS
foss-serial-min: [foss2023a-serial] -3.387894200000000e+00 2.000000032253979e-08 1.183431971747917e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -3.387894240000000e+00 -1.999999987845058e-08 -1.183431945470449e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -3.387894200000000e+00 2.000000032253979e-08 1.183431971747917e-01 PASS
intel_autotools: [intel2023a-serial] -3.387894200000000e+00 2.000000032253979e-08 1.183431971747917e-01 PASS
foss_ppc_autotools: [foss2022a-serial] -3.387894200000000e+00 2.000000032253979e-08 1.183431971747917e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -3.387894240000000e+00 -1.999999987845058e-08 -1.183431945470449e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] -3.387894240000000e+00 -1.999999987845058e-08 -1.183431945470449e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] -3.387894240000000e+00 -1.999999987845058e-08 -1.183431945470449e-01 PASS
intel_omp_autotools: [intel2022a-serial] -3.387894200000000e+00 2.000000032253979e-08 1.183431971747917e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -3.387894240000000e+00 -1.999999987845058e-08 -1.183431945470449e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -3.387894280000000e+00 -5.999999963535174e-08 -3.550295836411346e-01 PASS
foss-serial-min: [foss2023b-serial] -3.387894200000000e+00 2.000000032253979e-08 1.183431971747917e-01 PASS
foss-opt-full: [foss2023a-serial] -3.387894200000000e+00 2.000000032253979e-08 1.183431971747917e-01 PASS
intel_omp_autotools: [intel2023a-serial] -3.387894200000000e+00 2.000000032253979e-08 1.183431971747917e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -3.387894200000000e+00 2.000000032253979e-08 1.183431971747917e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -3.387894200000000e+00 2.000000032253979e-08 1.183431971747917e-01 PASS
foss-serial-debug: [foss2023a-serial] -3.387894200000000e+00 2.000000032253979e-08 1.183431971747917e-01 PASS
foss-omp-full: [foss2023a-serial] -3.387894200000000e+00 2.000000032253979e-08 1.183431971747917e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -3.387894240000000e+00 -1.999999987845058e-08 -1.183431945470449e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -3.387894240000000e+00 -1.999999987845058e-08 -1.183431945470449e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -3.387894240000000e+00 -1.999999987845058e-08 -1.183431945470449e-01 PASS
foss-mpi-min: [foss2022a-mpi] -3.387894240000000e+00 -1.999999987845058e-08 -1.183431945470449e-01 PASS
foss-mpi-min: [foss2023a-mpi] -3.387894240000000e+00 -1.999999987845058e-08 -1.183431945470449e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -3.387894240000000e+00 -1.999999987845058e-08 -1.183431945470449e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -3.387894240000000e+00 -1.999999987845058e-08 -1.183431945470449e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -3.387894280000000e+00 -5.999999963535174e-08 -3.550295836411346e-01 PASS