Match comparison for Occupation Ni2 down 3d4 (match type 21943)

Commits > Commit b6caf805fea115365f1246dd8a44b3bc3b7dd03a > Input 02-ACBN0.01-nio.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
9.732669800000000e-01 4.870000000000000e-07 9.732669662500000e-01 9.688104818499075e-08 9.732670000000000e-01 1.299999999870849e-07 PASS
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Detailed information

Reference: 0.97326698, precision: 0.000000487
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min 9.732669200000000e-01 -5.999999996841865e-08 -1.232032853560958e-01 PASS
spack_foss-2023a_serial_min 9.732669200000000e-01 -5.999999996841865e-08 -1.232032853560958e-01 PASS
spack_foss-2022a_serial_opt 9.732669200000000e-01 -5.999999996841865e-08 -1.232032853560958e-01 PASS
spack_foss-2022a_serial 9.732669200000000e-01 -5.999999996841865e-08 -1.232032853560958e-01 PASS
spack_foss-2022a_ppc 9.732669000000000e-01 -7.999999995789153e-08 -1.642710471414611e-01 PASS
spack_foss-2022a_mpi_min 9.732671300000000e-01 1.499999999765578e-07 3.080082135042254e-01 PASS
spack_foss-2023a_mpi_min 9.732668700000000e-01 -1.099999999976120e-07 -2.258726899334949e-01 PASS
spack_foss-2022a_serial_debug 9.732669200000000e-01 -5.999999996841865e-08 -1.232032853560958e-01 PASS
spack_foss-2022a_mpi_opt 9.732671300000000e-01 1.499999999765578e-07 3.080082135042254e-01 PASS
spack_intel-2022a_serial_omp 9.732669200000000e-01 -5.999999996841865e-08 -1.232032853560958e-01 PASS
spack_foss-2022a_mpi 9.732671300000000e-01 1.499999999765578e-07 3.080082135042254e-01 PASS
spack_foss-2022a_cuda_serial 9.732668799999999e-01 -1.000000000583867e-07 -2.053388091547982e-01 PASS
spack_intel-2023a_impi 9.732668900000000e-01 -9.000000000813912e-08 -1.848049281481296e-01 PASS
spack_foss-2022a_mpi_debug 9.732671300000000e-01 1.499999999765578e-07 3.080082135042254e-01 PASS
spack_foss-2022a_cuda_mpi_omp 9.732669700000000e-01 -1.000000005024759e-08 -2.053388100666857e-02 PASS
spack_intel-2022a_impi_omp 9.732669100000000e-01 -7.000000001866624e-08 -1.437371663627644e-01 PASS