Match comparison for X Coordinate Atom 1 [step 40] (match type 14061)

Commits > Commit 42d5c2c12b8376ac01df1778205b77ce6ca96480 > Input 19-td_move_ions.03-td_restart.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.653008990442350e-01 1.330000000000000e-15 -2.653008990442349e-01 0.000000000000000e+00 -2.653008990442349e-01 0.000000000000000e+00 PASS
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Detailed information

Reference: -0.265300899044235, precision: 0.00000000000000133
Run Value Difference Relative difference Status
cmake_foss_2022a_full_serial -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
cmake_foss_2022a_full_mpi -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
cmake_foss_2022a_min_serial -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
cmake_foss_2022a_min_mpi -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
spack_foss-2022a_cuda_mpi_omp -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
spack_foss-2022a_mpi -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
spack_foss-2022a_mpi_min -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
spack_foss-2022a_serial -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
spack_foss-2022a_serial_min -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
spack_foss-2023a_mpi -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
spack_foss-2023a_mpi_min -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
spack_foss-2022a_cuda_serial -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
spack_foss-2023a_serial -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
spack_foss-2023a_mpi_opt -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
spack_foss-2023a_serial_min -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
spack_foss-2023a_mpi_omp -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
spack_foss-2023a_serial_opt -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
spack_foss-2023a_serial_omp -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
spack_foss-2023b_serial -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
spack_intel-2023a_serial -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
spack_intel-2022a_serial_omp -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
spack_intel-2023a_impi -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
spack_intel-2023a_serial_omp -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS
spack_intel-2022a_impi_omp -2.653008990442349e-01 5.551115123125783e-17 4.173770769267506e-02 PASS