Match comparison for Projections 1-1 [step 0] (match type 29475)
Commits >
Commit 42d5c2c12b8376ac01df1778205b77ce6ca96480 >
Input 24-adsic_freeze_orbitals.02-td.inp
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
0.000000000000000e+00 | 1.000000000000000e-04 | -6.576443575830011e-18 | 7.030957578734579e-17 | -1.509209424099822e-16 | 1.821459649775647e-16 | PASS |
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Detailed information
Reference: 0.0, precision: 0.0001Run | Value | Difference | Relative difference | Status |
cmake_foss_2022a_full_serial | 9.510582929954290e-18 | 9.510582929954290e-18 | 9.510582929954289e-14 | PASS |
cmake_foss_2022a_full_mpi | 3.122502256758253e-17 | 3.122502256758253e-17 | 3.122502256758253e-13 | PASS |
cmake_foss_2022a_min_serial | 9.510582929954290e-18 | 9.510582929954290e-18 | 9.510582929954289e-14 | PASS |
cmake_foss_2022a_min_mpi | -3.330669073875470e-16 | -3.330669073875470e-16 | -3.330669073875470e-12 | PASS |
spack_foss-2022a_cuda_mpi_omp | -5.377642775528102e-17 | -5.377642775528102e-17 | -5.377642775528102e-13 | PASS |
spack_foss-2022a_mpi | 3.469446951953614e-18 | 3.469446951953614e-18 | 3.469446951953614e-14 | PASS |
spack_foss-2022a_mpi_min | 3.469446951953614e-18 | 3.469446951953614e-18 | 3.469446951953614e-14 | PASS |
spack_foss-2022a_serial | 2.231318121284612e-17 | 2.231318121284612e-17 | 2.231318121284612e-13 | PASS |
spack_foss-2022a_serial_min | 2.231318121284612e-17 | 2.231318121284612e-17 | 2.231318121284612e-13 | PASS |
spack_foss-2023a_mpi | 3.469446951953614e-18 | 3.469446951953614e-18 | 3.469446951953614e-14 | PASS |
spack_foss-2023a_mpi_min | 3.469446951953614e-18 | 3.469446951953614e-18 | 3.469446951953614e-14 | PASS |
spack_foss-2022a_cuda_serial | -1.113181989162665e-17 | -1.113181989162665e-17 | -1.113181989162665e-13 | PASS |
spack_foss-2023a_serial | 2.231318121284612e-17 | 2.231318121284612e-17 | 2.231318121284612e-13 | PASS |
spack_foss-2023a_mpi_opt | 3.122502256758253e-17 | 3.122502256758253e-17 | 3.122502256758253e-13 | PASS |
spack_foss-2023a_serial_min | 2.231318121284612e-17 | 2.231318121284612e-17 | 2.231318121284612e-13 | PASS |
spack_foss-2023a_mpi_omp | -3.469446951953614e-18 | -3.469446951953614e-18 | -3.469446951953614e-14 | PASS |
spack_foss-2023a_serial_opt | 9.510582929954290e-18 | 9.510582929954290e-18 | 9.510582929954289e-14 | PASS |
spack_foss-2023a_serial_omp | 1.105683081042079e-17 | 1.105683081042079e-17 | 1.105683081042079e-13 | PASS |
spack_foss-2023b_serial | 2.231318121284612e-17 | 2.231318121284612e-17 | 2.231318121284612e-13 | PASS |
spack_intel-2023a_serial | 1.026683174126351e-17 | 1.026683174126351e-17 | 1.026683174126351e-13 | PASS |
spack_intel-2022a_serial_omp | -2.959963702380589e-18 | -2.959963702380589e-18 | -2.959963702380589e-14 | PASS |
spack_intel-2023a_impi | -1.040834085586084e-17 | -1.040834085586084e-17 | -1.040834085586084e-13 | PASS |
spack_intel-2023a_serial_omp | -5.057018287703190e-18 | -5.057018287703190e-18 | -5.057018287703190e-14 | PASS |
spack_intel-2022a_impi_omp | 2.428612866367530e-17 | 2.428612866367530e-17 | 2.428612866367530e-13 | PASS |