Match comparison for Energy [step 10] (match type 14050)

Commits > Commit 9c86d3f9e0672ab6f34186f0e6ca5b729d8f047e > Input 19-td_move_ions.02-td.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.964441869043860e+01 1.480000000000000e-12 -2.964441869043870e+01 7.974300643553943e-14 -2.964441869043871e+01 1.580957587066223e-13 PASS

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Detailed information

Reference: -29.6444186904386, precision: 0.00000000000148
Run Value Difference Relative difference Status
cmake_foss_2022a_full_serial -2.964441869043873e+01 -1.350031197944190e-13 -9.121832418541827e-02 PASS
foss-2022a_ppc -2.964441869043874e+01 -1.456612608308205e-13 -9.841977083163550e-02 PASS
spack_foss-2022a_serial_min -2.964441869043871e+01 -1.101341240428155e-13 -7.441494867757806e-02 PASS
spack_foss-2022a_serial -2.964441869043871e+01 -1.101341240428155e-13 -7.441494867757806e-02 PASS
foss-2022a_opt -2.964441869043870e+01 -9.947598300641403e-14 -6.721350203136083e-02 PASS
cmake_foss_2022a_min_mpi -2.964441869043887e+01 -2.735589532676386e-13 -1.848371305862423e-01 PASS
intel-2022a -2.964441869043856e+01 3.552713678800501e-14 2.400482215405744e-02 PASS
cmake_foss_2022a_full_mpi -2.964441869043878e+01 -1.811883976188255e-13 -1.224245929856929e-01 PASS
spack_foss-2022a_serial_omp -2.964441869043876e+01 -1.598721155460225e-13 -1.080216996932585e-01 PASS
spack_foss-2022a_serial_debug -2.964441869043871e+01 -1.101341240428155e-13 -7.441494867757806e-02 PASS
foss-2022a_omp -2.964441869043876e+01 -1.598721155460225e-13 -1.080216996932585e-01 PASS
cmake_foss_2022a_min_serial -2.964441869043873e+01 -1.350031197944190e-13 -9.121832418541827e-02 PASS
eb_fosscuda-2022a -2.964441869043873e+01 -1.350031197944190e-13 -9.121832418541827e-02 PASS
intel-2022a_omp -2.964441869043859e+01 1.065814103640150e-14 7.201446646217232e-03 PASS
intel-2022b_impi -2.964441869043856e+01 4.263256414560601e-14 2.880578658486893e-02 PASS
intel-2022a_impi -2.964441869043856e+01 4.263256414560601e-14 2.880578658486893e-02 PASS
foss-2022a_mpi_omp -2.964441869043876e+01 -1.598721155460225e-13 -1.080216996932585e-01 PASS
eb_foss-2022a -2.964441869043872e+01 -1.207922650792170e-13 -8.161639532379529e-02 PASS
eb_foss-2022b_libxc6 -2.964441869043872e+01 -1.207922650792170e-13 -8.161639532379529e-02 PASS
eb_foss-2022a_debug -2.964441869043872e+01 -1.207922650792170e-13 -8.161639532379529e-02 PASS
intel-2022a_omp_impi -2.964441869043858e+01 1.776356839400250e-14 1.200241107702872e-02 PASS
eb_foss-2022a_mpi -2.964441869043874e+01 -1.421085471520200e-13 -9.601928861622976e-02 PASS
eb_foss-2022b_libxc6_mpi -2.964441869043874e+01 -1.421085471520200e-13 -9.601928861622976e-02 PASS
eb_foss-2022a_mpi_debug -2.964441869043874e+01 -1.421085471520200e-13 -9.601928861622976e-02 PASS
intel-2022b -2.964441869043856e+01 3.552713678800501e-14 2.400482215405744e-02 PASS
eb_fosscuda-2022a_mpi_omp -2.964441869043874e+01 -1.421085471520200e-13 -9.601928861622976e-02 PASS