Match comparison for Correlation energy (match type 12857)

Commits > Commit 3c86545dbb6a164adc7b03c9886fea0d0acfc59e > Input 31-acetylene_b3lyp.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.387894220000000e+00 1.690000000000000e-07 -3.387894218461539e+00 9.880948296784671e-09 -3.387894220000000e+00 1.000000016126990e-08 PASS

Checks for this match

  • MPI builders have different values.
Loading plot...
Get updated match line Get updated match line with fixed reference

Detailed information

Reference: -3.38789422, precision: 0.000000169
Run Value Difference Relative difference Status
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] -3.387894230000000e+00 -9.999999939225290e-09 -5.917159727352243e-02 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] -3.387894230000000e+00 -9.999999939225290e-09 -5.917159727352243e-02 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] -3.387894230000000e+00 -9.999999939225290e-09 -5.917159727352243e-02 PASS
GCI_foss_opt_autotools: [foss2023a-serial] -3.387894210000000e+00 1.000000038331450e-08 5.917159990126923e-02 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] -3.387894210000000e+00 1.000000038331450e-08 5.917159990126923e-02 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] -3.387894210000000e+00 1.000000038331450e-08 5.917159990126923e-02 PASS
GCI_intel_autotools: [intel2023a-serial] -3.387894210000000e+00 1.000000038331450e-08 5.917159990126923e-02 PASS
GCI_foss_omp_autotools: [foss2023a-serial] -3.387894210000000e+00 1.000000038331450e-08 5.917159990126923e-02 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] -3.387894230000000e+00 -9.999999939225290e-09 -5.917159727352243e-02 PASS
GCI_intel_omp_autotools: [intel2022a-serial] -3.387894210000000e+00 1.000000038331450e-08 5.917159990126923e-02 PASS
GCI_intel_omp_autotools: [intel2023a-serial] -3.387894210000000e+00 1.000000038331450e-08 5.917159990126923e-02 PASS
GCI_foss_ppc_autotools: [foss2022a-serial] -3.387894210000000e+00 1.000000038331450e-08 5.917159990126923e-02 PASS
GCI_foss_min_autotools: [foss2023a-serial] -3.387894210000000e+00 1.000000038331450e-08 5.917159990126923e-02 PASS
GCI_foss_min_autotools: [foss2022a-serial] -3.387894210000000e+00 1.000000038331450e-08 5.917159990126923e-02 PASS
GCI_foss_autotools: [foss2022a-serial] -3.387894210000000e+00 1.000000038331450e-08 5.917159990126923e-02 PASS
GCI_foss_autotools: [foss2023a-serial] -3.387894210000000e+00 1.000000038331450e-08 5.917159990126923e-02 PASS
GCI_foss_min_autotools: [foss2023b-serial] -3.387894210000000e+00 1.000000038331450e-08 5.917159990126923e-02 PASS
GCI_foss_autotools: [foss2023b-serial] -3.387894210000000e+00 1.000000038331450e-08 5.917159990126923e-02 PASS
GCI_foss_debug_autotools: [foss2023a-serial] -3.387894210000000e+00 1.000000038331450e-08 5.917159990126923e-02 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] -3.387894230000000e+00 -9.999999939225290e-09 -5.917159727352243e-02 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] -3.387894230000000e+00 -9.999999939225290e-09 -5.917159727352243e-02 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] -3.387894230000000e+00 -9.999999939225290e-09 -5.917159727352243e-02 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] -3.387894230000000e+00 -9.999999939225290e-09 -5.917159727352243e-02 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] -3.387894230000000e+00 -9.999999939225290e-09 -5.917159727352243e-02 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] -3.387894230000000e+00 -9.999999939225290e-09 -5.917159727352243e-02 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] -3.387894230000000e+00 -9.999999939225290e-09 -5.917159727352243e-02 PASS