Match comparison for gga_x_optpbe_vdw Int[n*v_xc] (match type 12341)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -3.998924350000000e-01 | 4.760000000000000e-06 | -3.998967539285714e-01 | 1.496168578099052e-08 | -3.998967550000000e-01 | 1.500000001986024e-08 | PASS |
Checks for this match
- MPI builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -0.39989243500000005, precision: 0.00000476| Run | Value | Difference | Relative difference | Status |
| foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] | -3.998967700000000e-01 | -4.334999999966449e-06 | -9.107142857072371e-01 | PASS |
| foss-serial-min: [foss2022a-serial] | -3.998967400000000e-01 | -4.304999999926729e-06 | -9.044117646904891e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | -3.998967400000000e-01 | -4.304999999926729e-06 | -9.044117646904891e-01 | PASS |
| foss-serial-min: [foss2023b-serial] | -3.998967400000000e-01 | -4.304999999926729e-06 | -9.044117646904891e-01 | PASS |
| foss-serial-min: [foss2023a-serial] | -3.998967400000000e-01 | -4.304999999926729e-06 | -9.044117646904891e-01 | PASS |
| foss-serial-full: [foss2023a-serial] | -3.998967400000000e-01 | -4.304999999926729e-06 | -9.044117646904891e-01 | PASS |
| foss-opt-full: [foss2023a-serial] | -3.998967400000000e-01 | -4.304999999926729e-06 | -9.044117646904891e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -3.998967400000000e-01 | -4.304999999926729e-06 | -9.044117646904891e-01 | PASS |
| intel-serial: [intel2023a-serial] | -3.998967400000000e-01 | -4.304999999926729e-06 | -9.044117646904891e-01 | PASS |
| foss-serial-full: [foss2023b-serial] | -3.998967400000000e-01 | -4.304999999926729e-06 | -9.044117646904891e-01 | PASS |
| foss-ppc: [foss2022a-serial] | -3.998967400000000e-01 | -4.304999999926729e-06 | -9.044117646904891e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -3.998967700000000e-01 | -4.334999999966449e-06 | -9.107142857072371e-01 | PASS |
| foss-serial-debug: [foss2023a-serial] | -3.998967400000000e-01 | -4.304999999926729e-06 | -9.044117646904891e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -3.998967700000000e-01 | -4.334999999966449e-06 | -9.107142857072371e-01 | PASS |
| intel-omp: [intel2023a-serial] | -3.998967400000000e-01 | -4.304999999926729e-06 | -9.044117646904891e-01 | PASS |
| intel-omp: [intel2022a-serial] | -3.998967400000000e-01 | -4.304999999926729e-06 | -9.044117646904891e-01 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | -3.998967700000000e-01 | -4.334999999966449e-06 | -9.107142857072371e-01 | PASS |
| foss-omp-full: [foss2023a-serial] | -3.998967400000000e-01 | -4.304999999926729e-06 | -9.044117646904891e-01 | PASS |
| foss-mpi-full: [foss2023a-mpi] | -3.998967700000000e-01 | -4.334999999966449e-06 | -9.107142857072371e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | -3.998967700000000e-01 | -4.334999999966449e-06 | -9.107142857072371e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | -3.998967700000000e-01 | -4.334999999966449e-06 | -9.107142857072371e-01 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | -3.998967700000000e-01 | -4.334999999966449e-06 | -9.107142857072371e-01 | PASS |
| foss-mpi-min: [foss2023a-mpi] | -3.998967700000000e-01 | -4.334999999966449e-06 | -9.107142857072371e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -3.998967700000000e-01 | -4.334999999966449e-06 | -9.107142857072371e-01 | PASS |
| foss-mpi-min: [foss2022a-mpi] | -3.998967700000000e-01 | -4.334999999966449e-06 | -9.107142857072371e-01 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | -3.998967700000000e-01 | -4.334999999966449e-06 | -9.107142857072371e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -3.998967700000000e-01 | -4.334999999966449e-06 | -9.107142857072371e-01 | PASS |
| foss-cmake-zen4: [foss2023a-serial, foss-full] | -3.998967400000000e-01 | -4.304999999926729e-06 | -9.044117646904891e-01 | PASS |