Match comparison for Total energy (match type 12964)

Commits > Commit bb686499811dbfe67b92ca3aeb5b2659998636fa > Input 03-sodium_chain.03-ground_state_disp.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
2.021960180000000e+00 1.010000000000000e-07 2.021960207962963e+00 4.027511673843575e-09 2.021960205000000e+00 4.999999969612645e-09 PASS

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Detailed information

Reference: 2.02196018, precision: 0.000000101
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
cmake_foss_2022a_full_serial 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
spack_foss-2022a_serial 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
spack_foss-2022a_ppc 2.021960200000000e+00 1.999999987845058e-08 1.980198007767384e-01 PASS
spack_foss-2022a_mpi_min 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] 2.021960200000000e+00 1.999999987845058e-08 1.980198007767384e-01 PASS
cmake_foss_2022a_full_mpi 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
spack_foss-2022a_mpi 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
cmake_foss_2022a_min_serial 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
spack_foss-2023a_mpi 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
cmake_foss_2022a_min_mpi 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_foss_opt_autotools: [foss2023a-serial] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_intel_autotools: [intel2023a-serial] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_foss_omp_autotools: [foss2023a-serial] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_intel_omp_autotools: [intel2023a-serial] 2.021960200000000e+00 1.999999987845058e-08 1.980198007767384e-01 PASS
GCI_intel_omp_autotools: [intel2022a-serial] 2.021960200000000e+00 1.999999987845058e-08 1.980198007767384e-01 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
spack_foss-2023a_mpi_debug 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_foss_ppc_autotools: [foss2022a-serial] 2.021960200000000e+00 1.999999987845058e-08 1.980198007767384e-01 PASS
GCI_foss_min_autotools: [foss2022a-serial] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_foss_min_autotools: [foss2023a-serial] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
spack_foss-2023a_mpi_min 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_foss_min_autotools: [foss2023b-serial] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_foss_autotools: [foss2022a-serial] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_foss_autotools: [foss2023a-serial] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_foss_autotools: [foss2023b-serial] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_foss_debug_autotools: [foss2023a-serial] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
spack_foss-2023a_serial 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
spack_foss-2023a_mpi_opt 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
spack_foss-2023a_serial_debug 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
spack_foss-2023a_serial_min 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
spack_foss-2023a_serial_opt 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
spack_foss-2023a_mpi_omp 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] 2.021960200000000e+00 1.999999987845058e-08 1.980198007767384e-01 PASS
spack_foss-2023b_serial 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
spack_foss-2023a_serial_omp 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
spack_intel-2023a_serial 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
spack_intel-2022a_serial_omp 2.021960200000000e+00 1.999999987845058e-08 1.980198007767384e-01 PASS
spack_intel-2023a_serial_omp 2.021960200000000e+00 1.999999987845058e-08 1.980198007767384e-01 PASS
spack_intel-2023a_impi 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
spack_intel-2022a_impi_omp 2.021960200000000e+00 1.999999987845058e-08 1.980198007767384e-01 PASS
spack_foss-2022a_cuda_mpi_omp 2.021960200000000e+00 1.999999987845058e-08 1.980198007767384e-01 PASS
spack_foss-2022a_cuda_serial 2.021960200000000e+00 1.999999987845058e-08 1.980198007767384e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] 2.021960210000000e+00 2.999999981767587e-08 2.970297011651076e-01 PASS