Match comparison for gga_x_pbek1_vdw Exchange (match type 12368)

Commits > Commit 8ce473bc2e5cdca8ff24e2d00f27e291b995e815 > Input 03-xc.gga_x_pbek1_vdw.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.204033250000000e-01 4.020000000000000e-06 -3.204063136363638e-01 2.100923055690185e-06 -3.204033300000000e-01 3.659999999988672e-06 PASS

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Detailed information

Reference: -0.320403325, precision: 0.00000402
Run Value Difference Relative difference Status
cuda-mpi-omp: [foss2022a-cuda-mpi] -3.203996700000000e-01 3.654999999991304e-06 9.092039800973394e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -3.203996700000000e-01 3.654999999991304e-06 9.092039800973394e-01 PASS
foss-serial-min: [foss2022a-serial] -3.204069700000000e-01 -3.644999999996568e-06 -9.067164179095940e-01 PASS
foss-serial-min: [foss2023b-serial] -3.204069700000000e-01 -3.644999999996568e-06 -9.067164179095940e-01 PASS
foss-serial-min: [foss2023a-serial] -3.204069700000000e-01 -3.644999999996568e-06 -9.067164179095940e-01 PASS
foss-opt-full: [foss2023a-serial] -3.204069700000000e-01 -3.644999999996568e-06 -9.067164179095940e-01 PASS
foss-serial-full: [foss2023b-serial] -3.204069700000000e-01 -3.644999999996568e-06 -9.067164179095940e-01 PASS
foss-serial-full: [foss2023a-serial] -3.204069700000000e-01 -3.644999999996568e-06 -9.067164179095940e-01 PASS
intel_autotools: [intel2023a-serial] -3.204069700000000e-01 -3.644999999996568e-06 -9.067164179095940e-01 PASS
foss-ppc: [foss2022a-serial] -3.204069700000000e-01 -3.644999999996568e-06 -9.067164179095940e-01 PASS
foss-serial-debug: [foss2023a-serial] -3.204069700000000e-01 -3.644999999996568e-06 -9.067164179095940e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -3.204069900000000e-01 -3.664999999986041e-06 -9.116915422850848e-01 PASS
intel_omp_autotools: [intel2023a-serial] -3.204069700000000e-01 -3.644999999996568e-06 -9.067164179095940e-01 PASS
foss-omp-full: [foss2023a-serial] -3.204069700000000e-01 -3.644999999996568e-06 -9.067164179095940e-01 PASS
intel_omp_autotools: [intel2022a-serial] -3.204069700000000e-01 -3.644999999996568e-06 -9.067164179095940e-01 PASS
foss-mpi-full: [foss2023a-mpi] -3.204069900000000e-01 -3.664999999986041e-06 -9.116915422850848e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -3.204069900000000e-01 -3.664999999986041e-06 -9.116915422850848e-01 PASS
foss-mpi-debug: [foss2023a-mpi] -3.204069900000000e-01 -3.664999999986041e-06 -9.116915422850848e-01 PASS
foss-mpi-min: [foss2022a-mpi] -3.204069900000000e-01 -3.664999999986041e-06 -9.116915422850848e-01 PASS
foss-mpi-min: [foss2023a-mpi] -3.204069900000000e-01 -3.664999999986041e-06 -9.116915422850848e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] -3.204069900000000e-01 -3.664999999986041e-06 -9.116915422850848e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -3.204069900000000e-01 -3.664999999986041e-06 -9.116915422850848e-01 PASS