Match comparison for van der Waals energy (match type 15709)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -1.836890000000000e-03 | 9.180000000000000e-08 | -1.836890000000000e-03 | 0.000000000000000e+00 | -1.836890000000000e-03 | 0.000000000000000e+00 | PASS |
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Detailed information
Reference: -0.0018368899999999999, precision: 0.0000000918| Run | Value | Difference | Relative difference | Status |
| foss-cmake-zen4: [foss2023a-serial, foss-min] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss-cmake-zen4: [foss2023a-serial, foss-full] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss-serial-min: [foss2023a-serial] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss-serial-min: [foss2022a-serial] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss-serial-min: [foss2023b-serial] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| intel_autotools: [intel2023a-serial] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss-opt-full: [foss2023a-serial] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss-serial-full: [foss2023b-serial] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss-ppc: [foss2022a-serial] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss-serial-debug: [foss2023a-serial] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss-serial-full: [foss2023a-serial] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss-omp-full: [foss2023a-serial] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss-mpi-full: [foss2023a-mpi] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss-mpi-min: [foss2022a-mpi] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss-mpi-min: [foss2023a-mpi] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| valgrind: [foss2023a-serial] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -1.836890000000000e-03 | -2.168404344971009e-19 | -2.362096236351862e-12 | PASS |