Match comparison for Populations [step 0] (match type 29471)
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 | 4.986686057502582e-33 | 2.209956419424830e-32 | 5.547116309091193e-32 | 5.546240170579251e-32 | PASS |
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Detailed information
Reference: 0.0, precision: 0.0001Run | Value | Difference | Relative difference | Status |
cmake_foss_2022a_full_serial | 9.045118766753793e-35 | 9.045118766753793e-35 | 9.045118766753792e-31 | PASS |
cmake_foss_2022a_full_mpi | 9.750020343460382e-34 | 9.750020343460382e-34 | 9.750020343460382e-30 | PASS |
cmake_foss_2022a_min_serial | 9.045118766753793e-35 | 9.045118766753793e-35 | 9.045118766753792e-31 | PASS |
cmake_foss_2022a_min_mpi | 1.109335647967044e-31 | 1.109335647967044e-31 | 1.109335647967044e-27 | PASS |
spack_foss-2022a_cuda_mpi_omp | 2.891904182118959e-33 | 2.891904182118959e-33 | 2.891904182118959e-29 | PASS |
spack_foss-2022a_mpi | 1.203706215242022e-35 | 1.203706215242022e-35 | 1.203706215242022e-31 | PASS |
spack_foss-2022a_mpi_min | 1.203706215242022e-35 | 1.203706215242022e-35 | 1.203706215242022e-31 | PASS |
spack_foss-2022a_serial | 4.978780558373092e-34 | 4.978780558373092e-34 | 4.978780558373092e-30 | PASS |
spack_foss-2022a_serial_min | 4.978780558373092e-34 | 4.978780558373092e-34 | 4.978780558373092e-30 | PASS |
spack_foss-2023a_mpi | 1.203706215242022e-35 | 1.203706215242022e-35 | 1.203706215242022e-31 | PASS |
spack_foss-2023a_mpi_min | 1.203706215242022e-35 | 1.203706215242022e-35 | 1.203706215242022e-31 | PASS |
spack_foss-2022a_cuda_serial | 1.239174140996147e-34 | 1.239174140996147e-34 | 1.239174140996147e-30 | PASS |
spack_foss-2023a_serial | 4.978780558373092e-34 | 4.978780558373092e-34 | 4.978780558373092e-30 | PASS |
spack_foss-2023a_mpi_opt | 9.750020343460382e-34 | 9.750020343460382e-34 | 9.750020343460382e-30 | PASS |
spack_foss-2023a_serial_min | 4.978780558373092e-34 | 4.978780558373092e-34 | 4.978780558373092e-30 | PASS |
spack_foss-2023a_mpi_omp | 1.203706215242022e-35 | 1.203706215242022e-35 | 1.203706215242022e-31 | PASS |
spack_foss-2023a_serial_opt | 9.045118766753793e-35 | 9.045118766753793e-35 | 9.045118766753792e-31 | PASS |
spack_foss-2023a_serial_omp | 1.222535075702704e-34 | 1.222535075702704e-34 | 1.222535075702704e-30 | PASS |
spack_foss-2023b_serial | 4.978780558373092e-34 | 4.978780558373092e-34 | 4.978780558373092e-30 | PASS |
spack_intel-2023a_serial | 1.054078340034159e-34 | 1.054078340034159e-34 | 1.054078340034159e-30 | PASS |
spack_intel-2022a_serial_omp | 8.761385119410602e-36 | 8.761385119410602e-36 | 8.761385119410602e-32 | PASS |
spack_intel-2023a_impi | 1.083335593717820e-34 | 1.083335593717820e-34 | 1.083335593717820e-30 | PASS |
spack_intel-2023a_serial_omp | 2.557343396216451e-35 | 2.557343396216451e-35 | 2.557343396216451e-31 | PASS |
spack_intel-2022a_impi_omp | 5.898160454685910e-34 | 5.898160454685910e-34 | 5.898160454685910e-30 | PASS |