Match comparison for Exchange energy (match type 24299)

Commits > Commit adb0a770f40b5954f8a07de2fe2e63c9718fe526 > Input 18-TiO2.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.164498139000000e+01 1.500000000000000e-06 -3.164498181730769e+01 4.848676083153704e-07 -3.164498171500000e+01 8.949999994456448e-07 PASS

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Detailed information

Reference: -31.644981389999998, precision: 0.0000015
Run Value Difference Relative difference Status
foss-2022a_ppc -3.164498172000000e+01 -3.300000024353267e-07 -2.200000016235511e-01 PASS
cmake_foss_2022a_full_serial -3.164498151000000e+01 -1.200000028234172e-07 -8.000000188227811e-02 PASS
cmake_foss_2022a_min_serial -3.164498151000000e+01 -1.200000028234172e-07 -8.000000188227811e-02 PASS
cmake_foss_2022a_min_mpi -3.164498183000000e+01 -4.400000008786265e-07 -2.933333339190843e-01 PASS
cmake_foss_2022a_full_mpi -3.164498244000000e+01 -1.050000001612261e-06 -7.000000010748408e-01 PASS
eb_fosscuda-2022a -3.164498154000000e+01 -1.500000017529146e-07 -1.000000011686097e-01 PASS
eb_foss-2022a -3.164498259000000e+01 -1.200000003365176e-06 -8.000000022434506e-01 PASS
eb_foss-2022a_debug -3.164498259000000e+01 -1.200000003365176e-06 -8.000000022434506e-01 PASS
eb_foss-2022b_libxc6 -3.164498170000000e+01 -3.100000007805193e-07 -2.066666671870128e-01 PASS
eb_foss-2022a_mpi -3.164498082000000e+01 5.699999974240200e-07 3.799999982826799e-01 PASS
foss-2022a_opt -3.164498259000000e+01 -1.200000003365176e-06 -8.000000022434506e-01 PASS
intel-2022a -3.164498261000000e+01 -1.220000001467270e-06 -8.133333343115130e-01 PASS
eb_foss-2022b_libxc6_mpi -3.164498189000000e+01 -5.000000022903350e-07 -3.333333348602234e-01 PASS
foss-2022a_omp -3.164498188000000e+01 -4.900000014629313e-07 -3.266666676419542e-01 PASS
intel-2022b -3.164498261000000e+01 -1.220000001467270e-06 -8.133333343115130e-01 PASS
spack_foss-2022a_serial -3.164498151000000e+01 -1.200000028234172e-07 -8.000000188227811e-02 PASS
eb_fosscuda-2022a_mpi_omp -3.164498169000000e+01 -3.000000035058292e-07 -2.000000023372195e-01 PASS
intel-2022a_omp -3.164498166000000e+01 -2.700000010236181e-07 -1.800000006824121e-01 PASS
intel-2022a_impi -3.164498164000000e+01 -2.500000029215244e-07 -1.666666686143496e-01 PASS
spack_foss-2022a_serial_min -3.164498151000000e+01 -1.200000028234172e-07 -8.000000188227811e-02 PASS
spack_foss-2022a_serial_debug -3.164498151000000e+01 -1.200000028234172e-07 -8.000000188227811e-02 PASS
intel-2022b_impi -3.164498164000000e+01 -2.500000029215244e-07 -1.666666686143496e-01 PASS
foss-2022a_mpi_omp -3.164498185000000e+01 -4.600000025334339e-07 -3.066666683556226e-01 PASS
spack_foss-2022a_serial_omp -3.164498180000000e+01 -4.100000019491290e-07 -2.733333346327527e-01 PASS
intel-2022a_omp_impi -3.164498179000000e+01 -4.000000011217253e-07 -2.666666674144835e-01 PASS
eb_foss-2022a_mpi_debug -3.164498082000000e+01 5.699999974240200e-07 3.799999982826799e-01 PASS