Match comparison for Total energy (match type 15669)

Commits > Commit 3c86545dbb6a164adc7b03c9886fea0d0acfc59e > Input 13-libvdwxc_h2o.01-vdwdfcx.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.712085937000000e+01 8.560000000000000e-08 -1.712085937000000e+01 0.000000000000000e+00 -1.712085937000000e+01 0.000000000000000e+00 PASS
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Detailed information

Reference: -17.120859369999998, precision: 0.0000000856
Run Value Difference Relative difference Status
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] -1.712085937000000e+01 -3.552713678800501e-15 -4.150366447196847e-08 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] -1.712085937000000e+01 -3.552713678800501e-15 -4.150366447196847e-08 PASS
GCI_foss_opt_autotools: [foss2023a-serial] -1.712085937000000e+01 -3.552713678800501e-15 -4.150366447196847e-08 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] -1.712085937000000e+01 -3.552713678800501e-15 -4.150366447196847e-08 PASS
GCI_intel_autotools: [intel2023a-serial] -1.712085937000000e+01 -3.552713678800501e-15 -4.150366447196847e-08 PASS
GCI_foss_omp_autotools: [foss2023a-serial] -1.712085937000000e+01 -3.552713678800501e-15 -4.150366447196847e-08 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] -1.712085937000000e+01 -3.552713678800501e-15 -4.150366447196847e-08 PASS
GCI_intel_omp_autotools: [intel2022a-serial] -1.712085937000000e+01 -3.552713678800501e-15 -4.150366447196847e-08 PASS
GCI_intel_omp_autotools: [intel2023a-serial] -1.712085937000000e+01 -3.552713678800501e-15 -4.150366447196847e-08 PASS
GCI_foss_ppc_autotools: [foss2022a-serial] -1.712085937000000e+01 -3.552713678800501e-15 -4.150366447196847e-08 PASS
GCI_foss_autotools: [foss2022a-serial] -1.712085937000000e+01 -3.552713678800501e-15 -4.150366447196847e-08 PASS
GCI_foss_autotools: [foss2023a-serial] -1.712085937000000e+01 -3.552713678800501e-15 -4.150366447196847e-08 PASS
GCI_foss_autotools: [foss2023b-serial] -1.712085937000000e+01 -3.552713678800501e-15 -4.150366447196847e-08 PASS
GCI_foss_debug_autotools: [foss2023a-serial] -1.712085937000000e+01 -3.552713678800501e-15 -4.150366447196847e-08 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] -1.712085937000000e+01 -3.552713678800501e-15 -4.150366447196847e-08 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] -1.712085937000000e+01 -3.552713678800501e-15 -4.150366447196847e-08 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] -1.712085937000000e+01 -3.552713678800501e-15 -4.150366447196847e-08 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] -1.712085937000000e+01 -3.552713678800501e-15 -4.150366447196847e-08 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] -1.712085937000000e+01 -3.552713678800501e-15 -4.150366447196847e-08 PASS
GCI_foss_valgrind_autotools: [foss2023a-serial] -1.712085937000000e+01 -3.552713678800501e-15 -4.150366447196847e-08 PASS