Match comparison for External energy (match type 26862)

Commits > Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc > Input 10-vdw_d3_dna.02-gs_d3.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-8.194568874000000e+02 4.100000000000000e-07 -8.194568873682354e+02 2.255329967084224e-08 -8.194568873950000e+02 3.500002776490874e-08 PASS

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Detailed information

Reference: -819.4568874, precision: 0.00000041
Run Value Difference Relative difference Status
intel-serial: [intel2023a-serial] -8.194568873600000e+02 4.000003173132427e-08 9.756105300322993e-02 PASS
foss-serial: [foss2023a-serial] -8.194568873600000e+02 4.000003173132427e-08 9.756105300322993e-02 PASS
foss-serial-debug: [foss2023a-serial] -8.194568873600000e+02 4.000003173132427e-08 9.756105300322993e-02 PASS
intel-min-parallel: [intel2022a-mpi] -8.194568873600000e+02 4.000003173132427e-08 9.756105300322993e-02 PASS
ppc: [foss2023a-serial] -8.194568873600000e+02 4.000003173132427e-08 9.756105300322993e-02 PASS
autotools_foss_mpi_omp: [foss2023a-mpi] -8.194568873600000e+02 4.000003173132427e-08 9.756105300322993e-02 PASS
foss-parallel-debug: [foss2023a-mpi] -8.194568873600000e+02 4.000003173132427e-08 9.756105300322993e-02 PASS
intel-parallel: [intel2023a-mpi] -8.194568873600000e+02 4.000003173132427e-08 9.756105300322993e-02 PASS
foss-parallel: [foss2023a-mpi] -8.194568873600000e+02 4.000003173132427e-08 9.756105300322993e-02 PASS
foss-min-parallel: [foss2023b-mpi] -8.194568873600000e+02 4.000003173132427e-08 9.756105300322993e-02 PASS
autotools_intel_mpi_omp: [intel2023a-mpi] -8.194568873600000e+02 4.000003173132427e-08 9.756105300322993e-02 PASS
address-sanitizer: [foss2023a-serial, ci-foss-full] -8.194568873600000e+02 4.000003173132427e-08 9.756105300322993e-02 PASS
foss-min-parallel: [foss2022a-mpi] -8.194568873600000e+02 4.000003173132427e-08 9.756105300322993e-02 PASS
intel-serial-debug: [intel2023a-serial] -8.194568873600000e+02 4.000003173132427e-08 9.756105300322993e-02 PASS
intel-parallel-debug: [intel2023a-mpi] -8.194568873600000e+02 4.000003173132427e-08 9.756105300322993e-02 PASS
cuda: [foss2022a-cuda-mpi, ci-foss-full-cuda] -8.194568874300001e+02 -3.000002379849320e-08 -7.317078975242244e-02 PASS
cuda: [foss2022a-cuda-mpi, ci-foss-full-mpi-omp-cuda] -8.194568874300001e+02 -3.000002379849320e-08 -7.317078975242244e-02 PASS