Match comparison for z (C1) (t=400 au) (match type 26050)

Commits > Commit d89ed1adec8f63937926022ba961c15ddb98b66b > Input 11-dftbplus_ehrenfest.01-benzene.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
1.340356350000000e+00 1.000000000000000e-04 1.340363625098077e+00 1.463126246206778e-14 1.340363625098090e+00 3.297362383136715e-14 PASS

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Detailed information

Reference: 1.34035635, precision: 0.0001
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-full] 1.340363625098074e+00 7.275098074410735e-06 7.275098074410735e-02 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] 1.340363625098074e+00 7.275098074410735e-06 7.275098074410735e-02 PASS
foss-ppc: [foss2022a-serial] 1.340363625098057e+00 7.275098056869211e-06 7.275098056869211e-02 PASS
intel_omp_autotools: [intel2022a-serial] 1.340363625098085e+00 7.275098085068876e-06 7.275098085068876e-02 PASS
intel_omp_autotools: [intel2023a-serial] 1.340363625098085e+00 7.275098085068876e-06 7.275098085068876e-02 PASS
foss-serial-full: [foss2023a-serial] 1.340363625098070e+00 7.275098070191888e-06 7.275098070191888e-02 PASS
foss-serial-full: [foss2023b-serial] 1.340363625098070e+00 7.275098070191888e-06 7.275098070191888e-02 PASS
foss-opt-full: [foss2023a-serial] 1.340363625098070e+00 7.275098070191888e-06 7.275098070191888e-02 PASS
intel-serial: [intel2023a-serial] 1.340363625098123e+00 7.275098122816459e-06 7.275098122816459e-02 PASS
foss_cmake: [foss2022a-serial, foss-full] 1.340363625098070e+00 7.275098070191888e-06 7.275098070191888e-02 PASS
foss-mpi-full: [foss2023a-mpi] 1.340363625098070e+00 7.275098070191888e-06 7.275098070191888e-02 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 1.340363625098070e+00 7.275098070191888e-06 7.275098070191888e-02 PASS
foss-mpi-opt-full: [foss2023a-mpi] 1.340363625098070e+00 7.275098070191888e-06 7.275098070191888e-02 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 1.340363625098070e+00 7.275098070191888e-06 7.275098070191888e-02 PASS
cuda-serial: [foss2022a-cuda-mpi] 1.340363625098091e+00 7.275098090842036e-06 7.275098090842036e-02 PASS