Match comparison for Kinetic energy (libxc5) (match type 28093)

Commits > Commit 7a2cd2a0801cf0c9aaf759ff5aac90b0fe91b5f6 > Input 07-mgga.02-tb09_gs_nosymm.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
3.517331377000000e+01 1.760000000000000e-07 3.517331377038462e+01 1.742693982295424e-08 3.517331380500000e+01 4.500000017060302e-08 PASS

Checks for this match

  • Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Get updated match line Get updated match line with fixed reference

Detailed information

Reference: 35.17331377, precision: 0.000000176
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min 3.517331376000000e+01 -1.000000082740371e-08 -5.681818651933927e-02 PASS
cmake_foss_2022a_full_serial 3.517331376000000e+01 -1.000000082740371e-08 -5.681818651933927e-02 PASS
spack_foss-2022a_serial 3.517331376000000e+01 -1.000000082740371e-08 -5.681818651933927e-02 PASS
spack_foss-2022a_ppc 3.517331378000000e+01 1.000000082740371e-08 5.681818651933927e-02 PASS
spack_foss-2023a_mpi_min 3.517331377000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_min_serial 3.517331376000000e+01 -1.000000082740371e-08 -5.681818651933927e-02 PASS
spack_foss-2022a_mpi_min 3.517331377000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi 3.517331377000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_full_mpi 3.517331377000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi 3.517331377000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_min_mpi 3.517331377000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi_debug 3.517331377000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial 3.517331376000000e+01 -1.000000082740371e-08 -5.681818651933927e-02 PASS
spack_foss-2023a_mpi_opt 3.517331377000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_cuda_serial 3.517331377000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_debug 3.517331376000000e+01 -1.000000082740371e-08 -5.681818651933927e-02 PASS
spack_foss-2023a_serial_min 3.517331376000000e+01 -1.000000082740371e-08 -5.681818651933927e-02 PASS
spack_foss-2023a_serial_opt 3.517331376000000e+01 -1.000000082740371e-08 -5.681818651933927e-02 PASS
spack_foss-2023a_mpi_omp 3.517331379000000e+01 2.000000165480742e-08 1.136363730386785e-01 PASS
spack_foss-2023b_serial 3.517331376000000e+01 -1.000000082740371e-08 -5.681818651933927e-02 PASS
spack_foss-2023a_serial_omp 3.517331377000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2023a_serial 3.517331377000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2022a_serial_omp 3.517331385000000e+01 7.999999951380232e-08 4.545454517829678e-01 PASS
spack_intel-2023a_serial_omp 3.517331377000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2023a_impi 3.517331376000000e+01 -1.000000082740371e-08 -5.681818651933927e-02 PASS
spack_intel-2022a_impi_omp 3.517331377000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS