Match comparison for Total energy (match type 11912)

Commits > Commit 3f59639a2c09960e9ce8b923e2789a20396f5ecf > Input 38-carbon_atom_cgal_box.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.467349182000000e+02 7.340000000000000e-07 -1.467349183600000e+02 2.842170943040401e-14 -1.467349183600000e+02 0.000000000000000e+00 PASS

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Detailed information

Reference: -146.7349182, precision: 0.000000734
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS
spack_foss-2023a_serial_min -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS
spack_foss-2022a_serial -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS
spack_foss-2023a_serial -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS
cmake_foss_2022a_full_serial -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS
cmake_foss_2022a_full_mpi -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS
spack_foss-2023a_serial_debug -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS
spack_foss-2023a_mpi_opt -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS
spack_foss-2022a_mpi -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS
spack_foss-2023a_mpi -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS
spack_foss-2022a_cuda_serial -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS
spack_foss-2023a_mpi_debug -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS
spack_foss-2023a_mpi_omp -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS
spack_foss-2022a_cuda_mpi_omp -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS
spack_foss-2023a_serial_opt -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS
spack_foss-2023b_serial -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS
spack_foss-2023a_serial_omp -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS
spack_intel-2023a_serial -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS
spack_intel-2022a_serial_omp -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS
spack_intel-2023a_serial_omp -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS
spack_intel-2023a_impi -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS
spack_intel-2022a_impi_omp -1.467349183600000e+02 -1.599999848167499e-07 -2.179836305405312e-01 PASS