Match comparison for y (C5) (t=400 au) (match type 26048)

Commits > Commit c461bdde143a1ab201b7896fffa943f7e4c29d0f > Input 11-dftbplus_ehrenfest.01-benzene.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.362777940000000e+00 1.000000000000000e-04 -1.362785864004235e+00 1.112352610388971e-14 -1.362785864004232e+00 2.242650509742816e-14 PASS

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Detailed information

Reference: -1.36277794, precision: 0.0001
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-full] -1.362785864004254e+00 -7.924004254533656e-06 -7.924004254533656e-02 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -1.362785864004254e+00 -7.924004254533656e-06 -7.924004254533656e-02 PASS
foss_cmake: [foss2022a-serial, foss-full] -1.362785864004236e+00 -7.924004236103954e-06 -7.924004236103954e-02 PASS
intel-serial: [intel2023a-serial] -1.362785864004210e+00 -7.924004209680646e-06 -7.924004209680646e-02 PASS
foss-opt-full: [foss2023a-serial] -1.362785864004236e+00 -7.924004236103954e-06 -7.924004236103954e-02 PASS
foss-serial-full: [foss2023b-serial] -1.362785864004236e+00 -7.924004236103954e-06 -7.924004236103954e-02 PASS
foss-serial-full: [foss2023a-serial] -1.362785864004236e+00 -7.924004236103954e-06 -7.924004236103954e-02 PASS
foss-ppc: [foss2022a-serial] -1.362785864004233e+00 -7.924004232995330e-06 -7.924004232995330e-02 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -1.362785864004236e+00 -7.924004236103954e-06 -7.924004236103954e-02 PASS
intel_omp_autotools: [intel2022a-serial] -1.362785864004220e+00 -7.924004220116743e-06 -7.924004220116743e-02 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -1.362785864004236e+00 -7.924004236103954e-06 -7.924004236103954e-02 PASS
foss-mpi-opt-full: [foss2023a-mpi] -1.362785864004236e+00 -7.924004236103954e-06 -7.924004236103954e-02 PASS
intel_omp_autotools: [intel2023a-serial] -1.362785864004220e+00 -7.924004220116743e-06 -7.924004220116743e-02 PASS
foss-mpi-full: [foss2023a-mpi] -1.362785864004236e+00 -7.924004236103954e-06 -7.924004236103954e-02 PASS
cuda-serial: [foss2022a-cuda-mpi] -1.362785864004234e+00 -7.924004233883508e-06 -7.924004233883508e-02 PASS