Match comparison for Ion-ion energy (match type 30377)

Commits > Commit f72050fe95608e153e1887ef05d1ad42dc082fde > Input 31-acetylene_b3lyp.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
1.315759358000000e+01 6.579999999999999e-08 1.315759358000001e+01 7.105427357601002e-15 1.315759358000000e+01 0.000000000000000e+00 PASS
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Detailed information

Reference: 13.157593579999999, precision: 0.0000000658
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss-serial-min: [foss2023a-serial] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss-serial-min: [foss2022a-serial] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss-serial-full: [foss2023b-serial] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss-serial-min: [foss2023b-serial] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss-opt-full: [foss2023a-serial] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss-ppc: [foss2022a-serial] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss-serial-full: [foss2023a-serial] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss-serial-debug: [foss2023a-serial] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
intel_omp_autotools: [intel2023a-serial] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
intel_omp_autotools: [intel2022a-serial] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss-omp-full: [foss2023a-serial] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss-mpi-full: [foss2023a-mpi] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
intel_mpi_autotools: [intel2023a-mpi] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
intel-serial: [intel2023a-serial] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss_cmake: [foss2022a-serial, foss-min] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss_cmake: [foss2022a-serial, foss-full] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss-mpi-opt-full: [foss2023a-mpi] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss-mpi-debug: [foss2023a-mpi] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss-mpi-min: [foss2022a-mpi] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss-mpi-min: [foss2023a-mpi] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss-mpi-omp-full: [foss2023a-mpi] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS
cuda-serial: [foss2022a-cuda-mpi] 1.315759358000000e+01 1.776356839400250e-15 2.699630455015578e-08 PASS