Match comparison for External energy (match type 11896)

Commits > Commit b6caf805fea115365f1246dd8a44b3bc3b7dd03a > Input 15-fullerene_stdlcao.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-8.229007844870001e+03 4.110000000000000e-07 -8.229007844880000e+03 0.000000000000000e+00 -8.229007844880000e+03 0.000000000000000e+00 PASS
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Detailed information

Reference: -8229.00784487, precision: 0.000000411
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min -8.229007844880000e+03 -9.998984751291573e-09 -2.432843005180431e-02 PASS
spack_foss-2023a_serial_min -8.229007844880000e+03 -9.998984751291573e-09 -2.432843005180431e-02 PASS
spack_foss-2022a_serial_opt -8.229007844880000e+03 -9.998984751291573e-09 -2.432843005180431e-02 PASS
spack_foss-2022a_serial -8.229007844880000e+03 -9.998984751291573e-09 -2.432843005180431e-02 PASS
spack_foss-2022a_ppc -8.229007844880000e+03 -9.998984751291573e-09 -2.432843005180431e-02 PASS
spack_foss-2022a_mpi_min -8.229007844880000e+03 -9.998984751291573e-09 -2.432843005180431e-02 PASS
spack_foss-2023a_mpi_min -8.229007844880000e+03 -9.998984751291573e-09 -2.432843005180431e-02 PASS
spack_foss-2022a_serial_debug -8.229007844880000e+03 -9.998984751291573e-09 -2.432843005180431e-02 PASS
spack_foss-2022a_mpi_opt -8.229007844880000e+03 -9.998984751291573e-09 -2.432843005180431e-02 PASS
spack_intel-2022a_serial_omp -8.229007844880000e+03 -9.998984751291573e-09 -2.432843005180431e-02 PASS
spack_foss-2022a_mpi -8.229007844880000e+03 -9.998984751291573e-09 -2.432843005180431e-02 PASS
spack_foss-2022a_cuda_serial -8.229007844880000e+03 -9.998984751291573e-09 -2.432843005180431e-02 PASS
spack_intel-2023a_impi -8.229007844880000e+03 -9.998984751291573e-09 -2.432843005180431e-02 PASS
spack_foss-2022a_mpi_debug -8.229007844880000e+03 -9.998984751291573e-09 -2.432843005180431e-02 PASS
spack_foss-2022a_cuda_mpi_omp -8.229007844880000e+03 -9.998984751291573e-09 -2.432843005180431e-02 PASS
spack_intel-2022a_impi_omp -8.229007844880000e+03 -9.998984751291573e-09 -2.432843005180431e-02 PASS