Match comparison for Hartree energy (match type 28370)

Commits > Commit 3c86545dbb6a164adc7b03c9886fea0d0acfc59e > Input 10-intersite.02-silicon.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
1.729323236000000e+01 1.170000000000000e-06 1.729323164444444e+01 6.157340298384328e-07 1.729323236000000e+01 1.060000000663308e-06 PASS
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Detailed information

Reference: 17.293232359999998, precision: 0.00000117
Run Value Difference Relative difference Status
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] 1.729323131000000e+01 -1.049999998059548e-06 -8.974358957773910e-01 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] 1.729323131000000e+01 -1.049999998059548e-06 -8.974358957773910e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] 1.729323131000000e+01 -1.049999998059548e-06 -8.974358957773910e-01 PASS
GCI_foss_opt_autotools: [foss2023a-serial] 1.729323131000000e+01 -1.049999998059548e-06 -8.974358957773910e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] 1.729323131000000e+01 -1.049999998059548e-06 -8.974358957773910e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] 1.729323131000000e+01 -1.049999998059548e-06 -8.974358957773910e-01 PASS
GCI_intel_autotools: [intel2023a-serial] 1.729323197000000e+01 -3.899999967416079e-07 -3.333333305483828e-01 PASS
GCI_foss_omp_autotools: [foss2023a-serial] 1.729323130000000e+01 -1.059999998886951e-06 -9.059829050315823e-01 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] 1.729323197000000e+01 -3.899999967416079e-07 -3.333333305483828e-01 PASS
GCI_intel_omp_autotools: [intel2022a-serial] 1.729323265000000e+01 2.900000026784255e-07 2.478632501525004e-01 PASS
GCI_intel_omp_autotools: [intel2023a-serial] 1.729323268000000e+01 3.200000016079230e-07 2.735042748785667e-01 PASS
GCI_foss_ppc_autotools: [foss2022a-serial] 1.729323342000000e+01 1.060000002439665e-06 9.059829080680897e-01 PASS
GCI_foss_min_autotools: [foss2023a-serial] 1.729323131000000e+01 -1.049999998059548e-06 -8.974358957773910e-01 PASS
GCI_foss_min_autotools: [foss2022a-serial] 1.729323131000000e+01 -1.049999998059548e-06 -8.974358957773910e-01 PASS
GCI_foss_autotools: [foss2022a-serial] 1.729323131000000e+01 -1.049999998059548e-06 -8.974358957773910e-01 PASS
GCI_foss_autotools: [foss2023a-serial] 1.729323131000000e+01 -1.049999998059548e-06 -8.974358957773910e-01 PASS
GCI_foss_min_autotools: [foss2023b-serial] 1.729323131000000e+01 -1.049999998059548e-06 -8.974358957773910e-01 PASS
GCI_foss_autotools: [foss2023b-serial] 1.729323131000000e+01 -1.049999998059548e-06 -8.974358957773910e-01 PASS
GCI_foss_debug_autotools: [foss2023a-serial] 1.729323131000000e+01 -1.049999998059548e-06 -8.974358957773910e-01 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] 1.729323131000000e+01 -1.049999998059548e-06 -8.974358957773910e-01 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] 1.729323131000000e+01 -1.049999998059548e-06 -8.974358957773910e-01 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] 1.729323131000000e+01 -1.049999998059548e-06 -8.974358957773910e-01 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] 1.729323131000000e+01 -1.049999998059548e-06 -8.974358957773910e-01 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] 1.729323130000000e+01 -1.059999998886951e-06 -9.059829050315823e-01 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] 1.729323131000000e+01 -1.049999998059548e-06 -8.974358957773910e-01 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] 1.729323265000000e+01 2.900000026784255e-07 2.478632501525004e-01 PASS
GCI_foss_valgrind_autotools: [foss2023a-serial] 1.729323288000000e+01 5.200000039451425e-07 4.444444478163611e-01 PASS