Match comparison for PBE0 Fock Correlation (match type 12505)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -2.521371850000000e-01 | 3.100000000000000e-06 | -2.521393317647058e-01 | 1.813612693889165e-06 | -2.521371800000000e-01 | 2.819999999986722e-06 | PASS |
Checks for this match
- GPU builders have different values.
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Detailed information
Reference: -0.252137185, precision: 0.0000031| Run | Value | Difference | Relative difference | Status |
| intel-serial: [intel2023a-serial] | -2.521399900000000e-01 | -2.804999999994617e-06 | -9.048387096756830e-01 | PASS |
| foss-serial: [foss2023a-serial] | -2.521399900000000e-01 | -2.804999999994617e-06 | -9.048387096756830e-01 | PASS |
| foss-serial-debug: [foss2023a-serial] | -2.521399900000000e-01 | -2.804999999994617e-06 | -9.048387096756830e-01 | PASS |
| intel-min-parallel: [intel2022a-mpi] | -2.521399900000000e-01 | -2.804999999994617e-06 | -9.048387096756830e-01 | PASS |
| ppc: [foss2023a-serial] | -2.521399900000000e-01 | -2.804999999994617e-06 | -9.048387096756830e-01 | PASS |
| autotools_foss_mpi_omp: [foss2023a-mpi] | -2.521400000000000e-01 | -2.814999999989354e-06 | -9.080645161255980e-01 | PASS |
| foss-parallel-debug: [foss2023a-mpi] | -2.521400000000000e-01 | -2.814999999989354e-06 | -9.080645161255980e-01 | PASS |
| intel-parallel: [intel2023a-mpi] | -2.521399900000000e-01 | -2.804999999994617e-06 | -9.048387096756830e-01 | PASS |
| foss-parallel: [foss2023a-mpi] | -2.521400000000000e-01 | -2.814999999989354e-06 | -9.080645161255980e-01 | PASS |
| foss-min-parallel: [foss2023b-mpi] | -2.521400000000000e-01 | -2.814999999989354e-06 | -9.080645161255980e-01 | PASS |
| autotools_intel_mpi_omp: [intel2023a-mpi] | -2.521400000000000e-01 | -2.814999999989354e-06 | -9.080645161255980e-01 | PASS |
| address-sanitizer: [foss2023a-serial, ci-foss-full] | -2.521399900000000e-01 | -2.804999999994617e-06 | -9.048387096756830e-01 | PASS |
| foss-min-parallel: [foss2022a-mpi] | -2.521400000000000e-01 | -2.814999999989354e-06 | -9.080645161255980e-01 | PASS |
| intel-serial-debug: [intel2023a-serial] | -2.521399900000000e-01 | -2.804999999994617e-06 | -9.048387096756830e-01 | PASS |
| intel-parallel-debug: [intel2023a-mpi] | -2.521399900000000e-01 | -2.804999999994617e-06 | -9.048387096756830e-01 | PASS |
| cuda: [foss2022a-cuda-mpi, ci-foss-full-cuda] | -2.521343600000000e-01 | 2.824999999984090e-06 | 9.112903225755130e-01 | PASS |
| cuda: [foss2022a-cuda-mpi, ci-foss-full-mpi-omp-cuda] | -2.521343700000000e-01 | 2.814999999989354e-06 | 9.080645161255980e-01 | PASS |