Match comparison for Hartree energy (match type 31184)

Commits > Commit 94d58911903c32860449c62a795f2d74d19217f9 > Input 02-cu2_hgh.02_gs_current.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
1.109311722600000e+02 5.830000000000000e-07 1.109311721517647e+02 3.341668335191200e-07 1.109311722600000e+02 5.300000012198325e-07 PASS
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Detailed information

Reference: 110.93117226, precision: 0.000000583
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] 1.109311720800000e+02 -1.800000006824121e-07 -3.087478570881854e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] 1.109311720800000e+02 -1.800000006824121e-07 -3.087478570881854e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] 1.109311726700000e+02 4.099999983964153e-07 7.032590023952235e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] 1.109311725100000e+02 2.499999993688107e-07 4.288164654696581e-01 PASS
foss_min_autotools: [foss2022a-serial] 1.109311717300000e+02 -5.299999941144051e-07 -9.090908989955492e-01 PASS
foss_min_autotools: [foss2023b-serial] 1.109311717300000e+02 -5.299999941144051e-07 -9.090908989955492e-01 PASS
foss_min_autotools: [foss2023a-serial] 1.109311717300000e+02 -5.299999941144051e-07 -9.090908989955492e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] 1.109311723000000e+02 4.000000330961484e-08 6.861064032523986e-02 PASS
foss_cmake: [foss2022a-serial, foss-full] 1.109311725100000e+02 2.499999993688107e-07 4.288164654696581e-01 PASS
foss_autotools: [foss2022a-serial] 1.109311717300000e+02 -5.299999941144051e-07 -9.090908989955492e-01 PASS
foss_opt_autotools: [foss2023a-serial] 1.109311725100000e+02 2.499999993688107e-07 4.288164654696581e-01 PASS
foss_autotools: [foss2023a-serial] 1.109311717300000e+02 -5.299999941144051e-07 -9.090908989955492e-01 PASS
foss_autotools: [foss2023b-serial] 1.109311717300000e+02 -5.299999941144051e-07 -9.090908989955492e-01 PASS
intel_autotools: [intel2023a-serial] 1.109311725000000e+02 2.400000056468343e-07 4.116638175760452e-01 PASS
foss_mpi_min_autotools: [foss2022a-mpi] 1.109311721200000e+02 -1.399999973727972e-07 -2.401372167629455e-01 PASS
foss_omp_autotools: [foss2023a-serial] 1.109311722700000e+02 1.000000793283107e-08 1.715267226900698e-02 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 1.109311724900000e+02 2.299999977140033e-07 3.945111453070382e-01 PASS
foss_mpi_min_autotools: [foss2023a-mpi] 1.109311721200000e+02 -1.399999973727972e-07 -2.401372167629455e-01 PASS
foss_debug_autotools: [foss2023a-serial] 1.109311717300000e+02 -5.299999941144051e-07 -9.090908989955492e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 1.109311724900000e+02 2.299999977140033e-07 3.945111453070382e-01 PASS
intel_omp_autotools: [intel2023a-serial] 1.109311717700000e+02 -4.899999908047903e-07 -8.404802586703093e-01 PASS
intel_omp_autotools: [intel2022a-serial] 1.109311717700000e+02 -4.899999908047903e-07 -8.404802586703093e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] 1.109311724900000e+02 2.299999977140033e-07 3.945111453070382e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] 1.109311722400000e+02 -2.000000165480742e-08 -3.430532016261993e-02 PASS
foss_mpi_autotools: [foss2023a-mpi] 1.109311722400000e+02 -2.000000165480742e-08 -3.430532016261993e-02 PASS
foss_ppc_autotools: [foss2022a-serial] 1.109311724100000e+02 1.500000053056283e-07 2.572898890319525e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] 1.109311722400000e+02 -2.000000165480742e-08 -3.430532016261993e-02 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] 1.109311717700000e+02 -4.899999908047903e-07 -8.404802586703093e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] 1.109311717700000e+02 -4.899999908047903e-07 -8.404802586703093e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] 1.109311724400000e+02 1.800000006824121e-07 3.087478570881854e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] 1.109311722400000e+02 -2.000000165480742e-08 -3.430532016261993e-02 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] 1.109311727900000e+02 5.300000083252598e-07 9.090909233709432e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] 1.109311717900000e+02 -4.700000033608376e-07 -8.061749628830833e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 1.109311724400000e+02 1.800000006824121e-07 3.087478570881854e-01 PASS