Match comparison for External energy (match type 26102)

Commits > Commit b1773e3237a9e3fe1d68ecd7146c17ebbd95a961 > Input 18-TiO2.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.632512136200000e+02 1.540000000000000e-06 -1.632512129196491e+02 5.641014139024437e-07 -1.632512136250000e+02 1.135000005092479e-06 PASS
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Detailed information

Reference: -163.25121362000002, precision: 0.00000154
Run Value Difference Relative difference Status
GCI_foss_min_autotools: [foss2023a-serial] -1.632512126300000e+02 9.900000179641211e-07 6.428571545221565e-01 PASS
GCI_foss_opt_autotools: [foss2023a-serial] -1.632512126300000e+02 9.900000179641211e-07 6.428571545221565e-01 PASS
cmake_foss_2022a_full_serial -1.632512126300000e+02 9.900000179641211e-07 6.428571545221565e-01 PASS
GCI_foss_autotools: [foss2022a-serial] -1.632512126300000e+02 9.900000179641211e-07 6.428571545221565e-01 PASS
GCI_foss_autotools: [foss2023b-serial] -1.632512126300000e+02 9.900000179641211e-07 6.428571545221565e-01 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] -1.632512127000000e+02 9.200000192777225e-07 5.974026099205990e-01 PASS
spack_foss-2023a_serial_min -1.632512126300000e+02 9.900000179641211e-07 6.428571545221565e-01 PASS
spack_foss-2022a_serial_min -1.632512126300000e+02 9.900000179641211e-07 6.428571545221565e-01 PASS
spack_foss-2022a_ppc -1.632512147600000e+02 -1.139999994848040e-06 -7.402597369143116e-01 PASS
spack_foss-2022a_serial -1.632512126300000e+02 9.900000179641211e-07 6.428571545221565e-01 PASS
GCI_intel_omp_autotools: [intel2022a-serial] -1.632512125700000e+02 1.050000008717689e-06 6.818181874790186e-01 PASS
spack_foss-2023a_serial -1.632512126300000e+02 9.900000179641211e-07 6.428571545221565e-01 PASS
cmake_foss_2022a_min_mpi -1.632512135900000e+02 3.000002379849320e-08 1.948053493408649e-02 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] -1.632512126300000e+02 9.900000179641211e-07 6.428571545221565e-01 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] -1.632512135900000e+02 3.000002379849320e-08 1.948053493408649e-02 PASS
GCI_foss_debug_autotools: [foss2023a-serial] -1.632512126300000e+02 9.900000179641211e-07 6.428571545221565e-01 PASS
spack_foss-2022a_mpi_min -1.632512127000000e+02 9.200000192777225e-07 5.974026099205990e-01 PASS
spack_foss-2023a_mpi_min -1.632512127000000e+02 9.200000192777225e-07 5.974026099205990e-01 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] -1.632512127000000e+02 9.200000192777225e-07 5.974026099205990e-01 PASS
GCI_foss_ppc_autotools: [foss2022a-serial] -1.632512147600000e+02 -1.139999994848040e-06 -7.402597369143116e-01 PASS
cmake_foss_2022a_full_mpi -1.632512127000000e+02 9.200000192777225e-07 5.974026099205990e-01 PASS
spack_foss-2023a_mpi_opt -1.632512127000000e+02 9.200000192777225e-07 5.974026099205990e-01 PASS
cmake_foss_2022a_min_serial -1.632512126300000e+02 9.900000179641211e-07 6.428571545221565e-01 PASS
spack_foss-2023a_serial_debug -1.632512126300000e+02 9.900000179641211e-07 6.428571545221565e-01 PASS
spack_foss-2022a_mpi -1.632512127000000e+02 9.200000192777225e-07 5.974026099205990e-01 PASS
spack_foss-2023a_mpi -1.632512127000000e+02 9.200000192777225e-07 5.974026099205990e-01 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] -1.632512127000000e+02 9.200000192777225e-07 5.974026099205990e-01 PASS
GCI_foss_min_autotools: [foss2023b-serial] -1.632512126300000e+02 9.900000179641211e-07 6.428571545221565e-01 PASS
spack_foss-2023a_mpi_debug -1.632512127000000e+02 9.200000192777225e-07 5.974026099205990e-01 PASS
spack_foss-2023a_mpi_omp -1.632512139200000e+02 -2.999999821895472e-07 -1.948051832399657e-01 PASS
GCI_foss_autotools: [foss2023a-serial] -1.632512126300000e+02 9.900000179641211e-07 6.428571545221565e-01 PASS
GCI_foss_min_autotools: [foss2022a-serial] -1.632512126300000e+02 9.900000179641211e-07 6.428571545221565e-01 PASS
spack_foss-2022a_cuda_mpi_omp -1.632512141500000e+02 -5.299999941144051e-07 -3.441558403340293e-01 PASS
GCI_intel_autotools: [intel2023a-serial] -1.632512124900000e+02 1.130000015336918e-06 7.337662437252715e-01 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] -1.632512127000000e+02 9.200000192777225e-07 5.974026099205990e-01 PASS
spack_foss-2023a_serial_opt -1.632512126300000e+02 9.900000179641211e-07 6.428571545221565e-01 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] -1.632512135900000e+02 3.000002379849320e-08 1.948053493408649e-02 PASS
spack_foss-2023a_serial_omp -1.632512126900000e+02 9.300000272105535e-07 6.038961215652945e-01 PASS
GCI_foss_omp_autotools: [foss2023a-serial] -1.632512126900000e+02 9.300000272105535e-07 6.038961215652945e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] -1.632512126300000e+02 9.900000179641211e-07 6.428571545221565e-01 PASS
spack_foss-2023b_serial -1.632512126300000e+02 9.900000179641211e-07 6.428571545221565e-01 PASS
spack_intel-2023a_serial -1.632512124900000e+02 1.130000015336918e-06 7.337662437252715e-01 PASS
spack_intel-2022a_serial_omp -1.632512125700000e+02 1.050000008717689e-06 6.818181874790186e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] -1.632512135900000e+02 3.000002379849320e-08 1.948053493408649e-02 PASS
GCI_intel_omp_autotools: [intel2023a-serial] -1.632512125900000e+02 1.030000021273736e-06 6.688311826452831e-01 PASS
spack_intel-2023a_serial_omp -1.632512125900000e+02 1.030000021273736e-06 6.688311826452831e-01 PASS
GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] -1.632512125000000e+02 1.120000007404087e-06 7.272727320805761e-01 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] -1.632512139300000e+02 -3.099999901223782e-07 -2.012986948846612e-01 PASS
spack_intel-2023a_impi -1.632512139300000e+02 -3.099999901223782e-07 -2.012986948846612e-01 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] -1.632512139200000e+02 -2.999999821895472e-07 -1.948051832399657e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] -1.632512127000000e+02 9.200000192777225e-07 5.974026099205990e-01 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-min-mpi] -1.632512135900000e+02 3.000002379849320e-08 1.948053493408649e-02 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-full-mpi] -1.632512127000000e+02 9.200000192777225e-07 5.974026099205990e-01 PASS
spack_intel-2022a_impi_omp -1.632512127000000e+02 9.200000192777225e-07 5.974026099205990e-01 PASS
spack_foss-2022a_cuda_serial -1.632512125600000e+02 1.060000016650520e-06 6.883116991237140e-01 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] -1.632512127000000e+02 9.200000192777225e-07 5.974026099205990e-01 PASS
GCI_foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -1.632512128900000e+02 7.300000106624793e-07 4.740259809496619e-01 PASS