Match comparison for Kinetic energy (match type 13940)

Commits > Commit babc485c55a2119a415aa56305cb49f398154cb7 > Input 07-mgga.05-br89_primitive.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
8.469179329999999e+00 4.230000000000000e-07 8.469179327777777e+00 1.030402033894548e-08 8.469179320000000e+00 1.999999987845058e-08 PASS
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Detailed information

Reference: 8.46917933, precision: 0.000000423
Run Value Difference Relative difference Status
spack_foss-2022a_ppc 8.469179329999999e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_cuda_serial 8.469179340000000e+00 1.000000082740371e-08 2.364066389457142e-02 PASS
spack_foss-2022a_serial 8.469179329999999e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi 8.469179329999999e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_min 8.469179329999999e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi_min 8.469179329999999e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi_opt 8.469179329999999e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_opt 8.469179329999999e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_debug 8.469179329999999e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial 8.469179329999999e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_omp 8.469179340000000e+00 1.000000082740371e-08 2.364066389457142e-02 PASS
spack_foss-2022a_mpi_debug 8.469179329999999e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_min 8.469179329999999e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2022a_serial_omp 8.469179329999999e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2023a_serial 8.469179300000000e+00 -2.999999892949745e-08 -7.092198328486395e-02 PASS
spack_intel-2023a_serial_omp 8.469179329999999e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2023a_impi 8.469179300000000e+00 -2.999999892949745e-08 -7.092198328486395e-02 PASS
spack_intel-2022a_impi_omp 8.469179329999999e+00 0.000000000000000e+00 0.000000000000000e+00 PASS