Match comparison for Energy [step 100] (match type 29346)
Commits >
Commit 968a3ff7080ffa1f89f08d37efc7416527769dec >
Input 24-adsic_freeze_orbitals.02-td.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -1.989121104550133e+00 | 2.370000000000000e-14 | -1.989121104550123e+00 | 1.175233836814449e-14 | -1.989121104550133e+00 | 2.153832667772804e-14 | PASS |
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Detailed information
Reference: -1.9891211045501331, precision: 0.0000000000000237| Run | Value | Difference | Relative difference | Status |
| foss_cmake: [foss2022a-serial, foss-min] | -1.989121104550135e+00 | -1.776356839400250e-15 | -7.495176537553799e-02 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -1.989121104550135e+00 | -1.776356839400250e-15 | -7.495176537553799e-02 | PASS |
| foss_min_autotools: [foss2023a-serial] | -1.989121104550134e+00 | -4.440892098500626e-16 | -1.873794134388450e-02 | PASS |
| foss_min_autotools: [foss2023b-serial] | -1.989121104550134e+00 | -4.440892098500626e-16 | -1.873794134388450e-02 | PASS |
| foss_min_autotools: [foss2022a-serial] | -1.989121104550134e+00 | -4.440892098500626e-16 | -1.873794134388450e-02 | PASS |
| foss_opt_autotools: [foss2023a-serial] | -1.989121104550135e+00 | -1.776356839400250e-15 | -7.495176537553799e-02 | PASS |
| foss_autotools: [foss2023a-serial] | -1.989121104550134e+00 | -4.440892098500626e-16 | -1.873794134388450e-02 | PASS |
| foss_autotools: [foss2023b-serial] | -1.989121104550134e+00 | -4.440892098500626e-16 | -1.873794134388450e-02 | PASS |
| foss_autotools: [foss2022a-serial] | -1.989121104550134e+00 | -4.440892098500626e-16 | -1.873794134388450e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | -1.989121104550113e+00 | 2.042810365310288e-14 | 8.619453018186870e-01 | PASS |
| intel_autotools: [intel2023a-serial] | -1.989121104550136e+00 | -2.442490654175344e-15 | -1.030586773913647e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | -1.989121104550113e+00 | 2.042810365310288e-14 | 8.619453018186870e-01 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | -1.989121104550114e+00 | 1.909583602355269e-14 | 8.057314777870335e-01 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | -1.989121104550114e+00 | 1.909583602355269e-14 | 8.057314777870335e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -1.989121104550111e+00 | 2.198241588757810e-14 | 9.275280965222827e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -1.989121104550111e+00 | 2.198241588757810e-14 | 9.275280965222827e-01 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | -1.989121104550111e+00 | 2.198241588757810e-14 | 9.275280965222827e-01 | PASS |
| foss_omp_autotools: [foss2023a-serial] | -1.989121104550114e+00 | 1.887379141862766e-14 | 7.963625071150912e-01 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | -1.989121104550111e+00 | 2.176037128265307e-14 | 9.181591258503404e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -1.989121104550116e+00 | 1.731947918415244e-14 | 7.307797124114954e-01 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | -1.989121104550111e+00 | 2.176037128265307e-14 | 9.181591258503404e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -1.989121104550116e+00 | 1.709743457922741e-14 | 7.214107417395532e-01 | PASS |
| foss_debug_autotools: [foss2023a-serial] | -1.989121104550134e+00 | -4.440892098500626e-16 | -1.873794134388450e-02 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | -1.989121104550154e+00 | -2.109423746787797e-14 | -8.900522138345137e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -1.989121104550117e+00 | 1.620925615952729e-14 | 6.839348590517842e-01 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | -1.989121104550111e+00 | 2.176037128265307e-14 | 9.181591258503404e-01 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | -1.989121104550138e+00 | -4.884981308350689e-15 | -2.061173547827295e-01 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | -1.989121104550116e+00 | 1.731947918415244e-14 | 7.307797124114954e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -1.989121104550115e+00 | 1.798561299892754e-14 | 7.588866244273222e-01 | PASS |
| foss_valgrind_autotools: [foss2023a-serial] | -1.989121104550136e+00 | -3.330669073875470e-15 | -1.405345600791337e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -1.989121104550118e+00 | 1.465494392505207e-14 | 6.183520643481885e-01 | PASS |