Match comparison for M-solvent int. energy @ t=0 (match type 28574)

Commits > Commit fa579c158b779976d5f0fa5d04f6d011c21f022f > Input 29-pcm_chlorine_anion.02-td_prop-n60.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.215406787815954e+00 2.790000000000000e-13 -3.215406787815838e+00 5.207393544914717e-14 -3.215406787815870e+00 1.449951270160454e-13 PASS

Checks for this match

  • Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Get updated match line Get updated match line with fixed reference

Detailed information

Reference: -3.2154067878159545, precision: 0.000000000000279
Run Value Difference Relative difference Status
spack_foss-2023a_serial_min -3.215406787815870e+00 8.482103908136196e-14 3.040180612235195e-01 PASS
spack_foss-2022a_serial_min -3.215406787815870e+00 8.482103908136196e-14 3.040180612235195e-01 PASS
spack_foss-2023a_serial_opt -3.215406787815822e+00 1.327826737451687e-13 4.759235618106405e-01 PASS
spack_foss-2022a_serial -3.215406787815870e+00 8.482103908136196e-14 3.040180612235195e-01 PASS
spack_foss-2023a_serial -3.215406787815870e+00 8.482103908136196e-14 3.040180612235195e-01 PASS
spack_foss-2023b_serial -3.215406787815870e+00 8.482103908136196e-14 3.040180612235195e-01 PASS
spack_foss-2022a_ppc -3.215406787816015e+00 -6.039613253960852e-14 -2.164735933319301e-01 PASS
spack_foss-2022a_mpi_min -3.215406787815846e+00 1.088018564132653e-13 3.899708115170800e-01 PASS
spack_foss-2023a_mpi_min -3.215406787815846e+00 1.088018564132653e-13 3.899708115170800e-01 PASS
spack_foss-2023a_mpi_opt -3.215406787815822e+00 1.327826737451687e-13 4.759235618106405e-01 PASS
spack_foss-2023a_serial_debug -3.215406787815870e+00 8.482103908136196e-14 3.040180612235195e-01 PASS
spack_foss-2023a_serial_omp -3.215406787815725e+00 2.295941214924824e-13 8.229179981809404e-01 PASS
cmake_foss_2022a_full_mpi -3.215406787815822e+00 1.327826737451687e-13 4.759235618106405e-01 PASS
spack_foss-2022a_mpi -3.215406787815846e+00 1.088018564132653e-13 3.899708115170800e-01 PASS
spack_foss-2023a_mpi -3.215406787815846e+00 1.088018564132653e-13 3.899708115170800e-01 PASS
spack_foss-2023a_mpi_debug -3.215406787815846e+00 1.088018564132653e-13 3.899708115170800e-01 PASS
spack_foss-2022a_cuda_mpi_omp -3.215406787815870e+00 8.482103908136196e-14 3.040180612235195e-01 PASS
spack_foss-2023a_mpi_omp -3.215406787815870e+00 8.482103908136196e-14 3.040180612235195e-01 PASS
spack_foss-2022a_cuda_serial -3.215406787815773e+00 1.811883976188255e-13 6.494207799957904e-01 PASS
cmake_foss_2022a_min_serial -3.215406787815822e+00 1.327826737451687e-13 4.759235618106405e-01 PASS
cmake_foss_2022a_full_serial -3.215406787815822e+00 1.327826737451687e-13 4.759235618106405e-01 PASS
cmake_foss_2022a_min_mpi -3.215406787815797e+00 1.572075802869222e-13 5.634680297022300e-01 PASS
spack_intel-2023a_serial -3.215406787815822e+00 1.327826737451687e-13 4.759235618106405e-01 PASS
spack_intel-2022a_serial_omp -3.215406787815846e+00 1.088018564132653e-13 3.899708115170800e-01 PASS
spack_intel-2023a_serial_omp -3.215406787815725e+00 2.295941214924824e-13 8.229179981809404e-01 PASS
spack_intel-2023a_impi -3.215406787815822e+00 1.327826737451687e-13 4.759235618106405e-01 PASS
spack_intel-2022a_impi_omp -3.215406787815822e+00 1.327826737451687e-13 4.759235618106405e-01 PASS