Match comparison for Energy [step 2] (match type 29796)

Commits > Commit 1f10c93c74388b17aea6526c581521be8cd6aa14 > Input 10-bomd.03-td_restart.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.058224116264840e+01 1.220000000000000e-08 -1.058224116353285e+01 6.955259968300034e-09 -1.058224116261990e+01 7.149548508778025e-09 PASS

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Detailed information

Reference: -10.5822411626484, precision: 0.0000000122
Run Value Difference Relative difference Status
cmake_foss_2022a_min_serial -1.058224116957157e+01 -6.923173145878536e-09 -5.674732086785685e-01 PASS
cmake_foss_2022a_full_serial -1.058224116957157e+01 -6.923173145878536e-09 -5.674732086785685e-01 PASS
spack_foss-2022a_serial_min -1.058224116952264e+01 -6.874245173094096e-09 -5.634627191060734e-01 PASS
cmake_foss_2022a_min_mpi -1.058224115547984e+01 7.168564408743805e-09 5.875872466183447e-01 PASS
spack_foss-2022a_ppc -1.058224116976945e+01 -7.121046863289848e-09 -5.836923658434302e-01 PASS
spack_foss-2022a_serial -1.058224116952264e+01 -6.874245173094096e-09 -5.634627191060734e-01 PASS
cmake_foss_2022a_full_mpi -1.058224115547339e+01 7.175007255000310e-09 5.881153487705172e-01 PASS
spack_foss-2022a_mpi_min -1.058224115557066e+01 7.077737507188431e-09 5.801424186220026e-01 PASS
spack_foss-2022a_mpi -1.058224115547673e+01 7.171665927785398e-09 5.878414694906063e-01 PASS
spack_foss-2023a_mpi -1.058224115547673e+01 7.171665927785398e-09 5.878414694906063e-01 PASS
spack_foss-2023a_mpi_min -1.058224115557066e+01 7.077737507188431e-09 5.801424186220026e-01 PASS
spack_foss-2023a_serial -1.058224116952264e+01 -6.874245173094096e-09 -5.634627191060734e-01 PASS
spack_foss-2023a_mpi_opt -1.058224115547339e+01 7.175007255000310e-09 5.881153487705172e-01 PASS
spack_foss-2023a_mpi_debug -1.058224115547673e+01 7.171665927785398e-09 5.878414694906063e-01 PASS
spack_foss-2023a_serial_debug -1.058224116952264e+01 -6.874245173094096e-09 -5.634627191060734e-01 PASS
spack_foss-2023a_serial_min -1.058224116952264e+01 -6.874245173094096e-09 -5.634627191060734e-01 PASS
spack_foss-2022a_cuda_serial -1.058224116952744e+01 -6.879041336560476e-09 -5.638558472590555e-01 PASS
spack_foss-2023a_mpi_omp -1.058224115547035e+01 7.178050154266202e-09 5.883647667431313e-01 PASS
spack_foss-2023a_serial_opt -1.058224116957157e+01 -6.923173145878536e-09 -5.674732086785685e-01 PASS
spack_foss-2023a_serial_omp -1.058224116961740e+01 -6.969004928691902e-09 -5.712299121878608e-01 PASS
spack_foss-2023b_serial -1.058224116952264e+01 -6.874245173094096e-09 -5.634627191060734e-01 PASS
spack_foss-2022a_cuda_mpi_omp -1.058224115554760e+01 7.100798171677525e-09 5.820326370227479e-01 PASS
spack_intel-2023a_serial -1.058224116952781e+01 -6.879407266069393e-09 -5.638858414810978e-01 PASS
spack_intel-2022a_serial_omp -1.058224116954098e+01 -6.892584281104064e-09 -5.649659246806610e-01 PASS
spack_intel-2023a_serial_omp -1.058224116954098e+01 -6.892584281104064e-09 -5.649659246806610e-01 PASS
spack_intel-2023a_impi -1.058224115550385e+01 7.144548064275114e-09 5.856186937930421e-01 PASS
spack_intel-2022a_impi_omp -1.058224115550203e+01 7.146368830035499e-09 5.857679368881556e-01 PASS
spack_foss-2023a_valgrind -1.058224116952309e+01 -6.874694591374464e-09 -5.634995566700380e-01 PASS