Match comparison for X Force Atom 1 [step 40] (match type 14065)

Commits > Commit 3186a8a51be7ad5a27ccff6e8e2901df0a16a559 > Input 19-td_move_ions.03-td_restart.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.570779273623162e+01 1.570000000000000e-13 -1.570779273623163e+01 1.815885069001843e-14 -1.570779273623162e+01 2.930988785010413e-14 PASS
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Detailed information

Reference: -15.707792736231621, precision: 0.000000000000157
Run Value Difference Relative difference Status
spack_foss-2023a_serial_min -1.570779273623164e+01 -1.953992523340276e-14 -1.244581225057500e-01 PASS
spack_foss-2023a_serial_opt -1.570779273623165e+01 -3.197442310920451e-14 -2.036587459185000e-01 PASS
spack_foss-2022a_serial -1.570779273623164e+01 -1.953992523340276e-14 -1.244581225057500e-01 PASS
spack_foss-2022a_serial_min -1.570779273623164e+01 -1.953992523340276e-14 -1.244581225057500e-01 PASS
spack_foss-2022a_ppc -1.570779273623162e+01 3.552713678800501e-15 2.262874954650001e-02 PASS
spack_foss-2023a_serial -1.570779273623164e+01 -1.953992523340276e-14 -1.244581225057500e-01 PASS
spack_foss-2023b_serial -1.570779273623164e+01 -1.953992523340276e-14 -1.244581225057500e-01 PASS
spack_foss-2022a_mpi_min -1.570779273623162e+01 3.552713678800501e-15 2.262874954650001e-02 PASS
spack_foss-2023a_mpi_min -1.570779273623162e+01 3.552713678800501e-15 2.262874954650001e-02 PASS
spack_foss-2023a_serial_omp -1.570779273623161e+01 1.421085471520200e-14 9.051499818600002e-02 PASS
spack_foss-2023a_mpi_opt -1.570779273623163e+01 -8.881784197001252e-15 -5.657187386625001e-02 PASS
spack_foss-2022a_mpi -1.570779273623162e+01 3.552713678800501e-15 2.262874954650001e-02 PASS
spack_foss-2023a_mpi -1.570779273623162e+01 3.552713678800501e-15 2.262874954650001e-02 PASS
spack_foss-2023a_serial_debug -1.570779273623164e+01 -1.953992523340276e-14 -1.244581225057500e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] -1.570779273623165e+01 -3.197442310920451e-14 -2.036587459185000e-01 PASS
GCI_foss_opt_autotools: [foss2023a-serial] -1.570779273623165e+01 -3.197442310920451e-14 -2.036587459185000e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] -1.570779273623165e+01 -3.197442310920451e-14 -2.036587459185000e-01 PASS
spack_foss-2023a_mpi_debug -1.570779273623162e+01 3.552713678800501e-15 2.262874954650001e-02 PASS
GCI_intel_autotools: [intel2023a-serial] -1.570779273623165e+01 -3.197442310920451e-14 -2.036587459185000e-01 PASS
GCI_intel_omp_autotools: [intel2023a-serial] -1.570779273623159e+01 2.664535259100376e-14 1.697156215987500e-01 PASS
GCI_intel_omp_autotools: [intel2022a-serial] -1.570779273623159e+01 2.664535259100376e-14 1.697156215987500e-01 PASS
GCI_foss_omp_autotools: [foss2023a-serial] -1.570779273623161e+01 1.421085471520200e-14 9.051499818600002e-02 PASS
GCI_foss_ppc_autotools: [foss2022a-serial] -1.570779273623162e+01 3.552713678800501e-15 2.262874954650001e-02 PASS
GCI_foss_min_autotools: [foss2022a-serial] -1.570779273623164e+01 -1.953992523340276e-14 -1.244581225057500e-01 PASS
GCI_foss_min_autotools: [foss2023a-serial] -1.570779273623164e+01 -1.953992523340276e-14 -1.244581225057500e-01 PASS
GCI_foss_min_autotools: [foss2023b-serial] -1.570779273623164e+01 -1.953992523340276e-14 -1.244581225057500e-01 PASS
GCI_foss_autotools: [foss2022a-serial] -1.570779273623164e+01 -1.953992523340276e-14 -1.244581225057500e-01 PASS
GCI_foss_autotools: [foss2023b-serial] -1.570779273623164e+01 -1.953992523340276e-14 -1.244581225057500e-01 PASS
GCI_foss_autotools: [foss2023a-serial] -1.570779273623164e+01 -1.953992523340276e-14 -1.244581225057500e-01 PASS
GCI_foss_debug_autotools: [foss2023a-serial] -1.570779273623164e+01 -1.953992523340276e-14 -1.244581225057500e-01 PASS
spack_foss-2023a_mpi_omp -1.570779273623162e+01 3.552713678800501e-15 2.262874954650001e-02 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] -1.570779273623162e+01 3.552713678800501e-15 2.262874954650001e-02 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] -1.570779273623162e+01 3.552713678800501e-15 2.262874954650001e-02 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] -1.570779273623162e+01 3.552713678800501e-15 2.262874954650001e-02 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] -1.570779273623162e+01 3.552713678800501e-15 2.262874954650001e-02 PASS
cmake_foss_2022a_full_serial -1.570779273623165e+01 -3.197442310920451e-14 -2.036587459185000e-01 PASS
cmake_foss_2022a_min_serial -1.570779273623165e+01 -3.197442310920451e-14 -2.036587459185000e-01 PASS
cmake_foss_2022a_min_mpi -1.570779273623159e+01 2.664535259100376e-14 1.697156215987500e-01 PASS
cmake_foss_2022a_full_mpi -1.570779273623163e+01 -8.881784197001252e-15 -5.657187386625001e-02 PASS
spack_intel-2022a_impi_omp -1.570779273623163e+01 -8.881784197001252e-15 -5.657187386625001e-02 PASS
spack_intel-2023a_serial -1.570779273623165e+01 -3.197442310920451e-14 -2.036587459185000e-01 PASS
spack_intel-2022a_serial_omp -1.570779273623159e+01 2.664535259100376e-14 1.697156215987500e-01 PASS
spack_intel-2023a_serial_omp -1.570779273623159e+01 2.664535259100376e-14 1.697156215987500e-01 PASS
spack_intel-2023a_impi -1.570779273623162e+01 3.552713678800501e-15 2.262874954650001e-02 PASS
GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] -1.570779273623164e+01 -1.953992523340276e-14 -1.244581225057500e-01 PASS
spack_foss-2022a_cuda_mpi_omp -1.570779273623161e+01 1.421085471520200e-14 9.051499818600002e-02 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] -1.570779273623163e+01 -8.881784197001252e-15 -5.657187386625001e-02 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] -1.570779273623163e+01 -8.881784197001252e-15 -5.657187386625001e-02 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] -1.570779273623162e+01 3.552713678800501e-15 2.262874954650001e-02 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] -1.570779273623162e+01 3.552713678800501e-15 2.262874954650001e-02 PASS
spack_foss-2022a_cuda_serial -1.570779273623164e+01 -1.953992523340276e-14 -1.244581225057500e-01 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] -1.570779273623163e+01 -8.881784197001252e-15 -5.657187386625001e-02 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] -1.570779273623165e+01 -3.197442310920451e-14 -2.036587459185000e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] -1.570779273623159e+01 2.664535259100376e-14 1.697156215987500e-01 PASS