Match comparison for Benzene Multipoles [step 20] (match type 23477)

Commits > Commit 7368b0b20aad13e0ecfc3e36ba5b1a9f5c3d54b1 > Input 12-tddft-currents-to-maxwell.04-benzene-mxll-td-full-min-coup.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.094606295401846e-02 1.000000000000000e-12 -2.094606295401688e-02 7.146325031908186e-15 -2.094606295401883e-02 1.533842497458693e-14 PASS

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Detailed information

Reference: -0.02094606295401846, precision: 0.000000000001
Run Value Difference Relative difference Status
spack_foss-2022a_serial -2.094606295401286e-02 5.596217933501180e-15 5.596217933501180e-03 PASS
spack_foss-2022a_ppc -2.094606295401655e-02 1.911665270526441e-15 1.911665270526441e-03 PASS
spack_foss-2022a_mpi_min -2.094606295401674e-02 1.720845688168993e-15 1.720845688168993e-03 PASS
spack_foss-2022a_mpi -2.094606295401674e-02 1.720845688168993e-15 1.720845688168993e-03 PASS
cmake_foss_2022a_min_serial -2.094606295401286e-02 5.596217933501180e-15 5.596217933501180e-03 PASS
cmake_foss_2022a_full_serial -2.094606295401286e-02 5.596217933501180e-15 5.596217933501180e-03 PASS
cmake_foss_2022a_min_mpi -2.094606295400349e-02 1.497066359767985e-14 1.497066359767985e-02 PASS
spack_foss-2022a_serial_min -2.094606295401286e-02 5.596217933501180e-15 5.596217933501180e-03 PASS
cmake_foss_2022a_full_mpi -2.094606295401674e-02 1.720845688168993e-15 1.720845688168993e-03 PASS
spack_foss-2023a_serial -2.094606295401286e-02 5.596217933501180e-15 5.596217933501180e-03 PASS
spack_foss-2023a_mpi_min -2.094606295401674e-02 1.720845688168993e-15 1.720845688168993e-03 PASS
spack_foss-2023a_serial_min -2.094606295401286e-02 5.596217933501180e-15 5.596217933501180e-03 PASS
spack_foss-2023a_mpi -2.094606295401674e-02 1.720845688168993e-15 1.720845688168993e-03 PASS
spack_foss-2023a_mpi_opt -2.094606295401674e-02 1.720845688168993e-15 1.720845688168993e-03 PASS
spack_foss-2023a_serial_debug -2.094606295401286e-02 5.596217933501180e-15 5.596217933501180e-03 PASS
spack_foss-2023a_serial_opt -2.094606295401286e-02 5.596217933501180e-15 5.596217933501180e-03 PASS
spack_foss-2023a_serial_omp -2.094606295401887e-02 -4.093947403305265e-16 -4.093947403305265e-04 PASS
spack_foss-2023a_mpi_debug -2.094606295401674e-02 1.720845688168993e-15 1.720845688168993e-03 PASS
spack_foss-2023b_serial -2.094606295401286e-02 5.596217933501180e-15 5.596217933501180e-03 PASS
spack_foss-2023a_mpi_omp -2.094606295400688e-02 1.157754447866921e-14 1.157754447866921e-02 PASS
spack_foss-2022a_cuda_serial -2.094606295401544e-02 3.014949401247691e-15 3.014949401247691e-03 PASS
spack_foss-2022a_cuda_mpi_omp -2.094606295401204e-02 6.421946308066140e-15 6.421946308066140e-03 PASS
spack_intel-2023a_serial -2.094606295402481e-02 -6.345618475123160e-15 -6.345618475123160e-03 PASS
spack_intel-2022a_serial_omp -2.094606295403417e-02 -1.570618635149401e-14 -1.570618635149401e-02 PASS
spack_intel-2023a_serial_omp -2.094606295403417e-02 -1.570618635149401e-14 -1.570618635149401e-02 PASS
spack_intel-2023a_impi -2.094606295402612e-02 -7.660538869913580e-15 -7.660538869913580e-03 PASS
spack_intel-2022a_impi_omp -2.094606295403026e-02 -1.179611963664229e-14 -1.179611963664229e-02 PASS