Match comparison for External energy (match type 26102)

Commits > Commit 18848dd43b1805cec78813204483223eec09e06c > Input 18-TiO2.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.632512125600000e+02 1.960000000000000e-06 -1.632512132562500e+02 6.581211472524712e-07 -1.632512132700000e+02 9.400000067216752e-07 PASS

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Detailed information

Reference: -163.25121256, precision: 0.00000196
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -1.632512123300000e+02 2.300000119248580e-07 1.173469448596214e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -1.632512140200000e+02 -1.459999992903249e-06 -7.448979555628823e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -1.632512139000000e+02 -1.340000011396114e-06 -6.836734752020991e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -1.632512125600000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_min_autotools: [foss2023a-serial] -1.632512139000000e+02 -1.340000011396114e-06 -6.836734752020991e-01 PASS
foss_min_autotools: [foss2022a-serial] -1.632512139000000e+02 -1.340000011396114e-06 -6.836734752020991e-01 PASS
foss_autotools: [foss2022a-serial] -1.632512139000000e+02 -1.340000011396114e-06 -6.836734752020991e-01 PASS
foss_autotools: [foss2023a-serial] -1.632512139000000e+02 -1.340000011396114e-06 -6.836734752020991e-01 PASS
foss_mpi_min_autotools: [foss2022a-mpi] -1.632512127000000e+02 -1.399999973727972e-07 -7.142857008816185e-02 PASS
foss_debug_autotools: [foss2023a-serial] -1.632512139000000e+02 -1.340000011396114e-06 -6.836734752020991e-01 PASS
foss_min_autotools: [foss2023b-serial] -1.632512139000000e+02 -1.340000011396114e-06 -6.836734752020991e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -1.632512139000000e+02 -1.340000011396114e-06 -6.836734752020991e-01 PASS
foss_autotools: [foss2023b-serial] -1.632512139000000e+02 -1.340000011396114e-06 -6.836734752020991e-01 PASS
foss_opt_autotools: [foss2023a-serial] -1.632512139000000e+02 -1.340000011396114e-06 -6.836734752020991e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -1.632512139000000e+02 -1.340000011396114e-06 -6.836734752020991e-01 PASS
intel_autotools: [intel2023a-serial] -1.632512141200000e+02 -1.559999986966432e-06 -7.959183606971590e-01 PASS
foss_mpi_min_autotools: [foss2023a-mpi] -1.632512127000000e+02 -1.399999973727972e-07 -7.142857008816185e-02 PASS
foss_omp_autotools: [foss2023a-serial] -1.632512126600000e+02 -9.999999406318238e-08 -5.102040513427673e-02 PASS
foss_mpi_autotools: [foss2022a-mpi] -1.632512126600000e+02 -9.999999406318238e-08 -5.102040513427673e-02 PASS
foss_mpi_autotools: [foss2023a-mpi] -1.632512126600000e+02 -9.999999406318238e-08 -5.102040513427673e-02 PASS
foss_ppc_autotools: [foss2022a-serial] -1.632512126200000e+02 -5.999999075356754e-08 -3.061224018039161e-02 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -1.632512126600000e+02 -9.999999406318238e-08 -5.102040513427673e-02 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -1.632512126600000e+02 -9.999999406318238e-08 -5.102040513427673e-02 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -1.632512126600000e+02 -9.999999406318238e-08 -5.102040513427673e-02 PASS
intel_omp_autotools: [intel2023a-serial] -1.632512139900000e+02 -1.429999997526465e-06 -7.295918354726865e-01 PASS
intel_omp_autotools: [intel2022a-serial] -1.632512125400000e+02 1.999998744395270e-08 1.020407522650648e-02 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -1.632512127000000e+02 -1.399999973727972e-07 -7.142857008816185e-02 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -1.632512126600000e+02 -9.999999406318238e-08 -5.102040513427673e-02 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -1.632512127000000e+02 -1.399999973727972e-07 -7.142857008816185e-02 PASS
intel_mpi_autotools: [intel2023a-mpi] -1.632512142100000e+02 -1.650000001518492e-06 -8.418367354686186e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -1.632512128300000e+02 -2.699999868127634e-07 -1.377550953126344e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -1.632512126600000e+02 -9.999999406318238e-08 -5.102040513427673e-02 PASS