Match comparison for Energy [step 20] (match type 12076)
Commits >
Commit babc485c55a2119a415aa56305cb49f398154cb7 >
Input 14-fullerene_unpacked.03-td-packed.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -3.184088237668212e+02 | 1.590000000000000e-10 | -3.184088237668601e+02 | 7.597761800542572e-11 | -3.184088237668211e+02 | 8.793676897767000e-11 | PASS |
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Detailed information
Reference: -318.40882376682123, precision: 0.000000000159| Run | Value | Difference | Relative difference | Status |
| spack_foss-2022a_ppc | -3.184088237669055e+02 | -8.429879017057829e-11 | -5.301810702552093e-01 | PASS |
| spack_foss-2022a_cuda_serial | -3.184088237669064e+02 | -8.520828487235121e-11 | -5.359011627191901e-01 | PASS |
| spack_foss-2022a_serial | -3.184088237667331e+02 | 8.810729923425242e-11 | 5.541339574481284e-01 | PASS |
| spack_foss-2022a_mpi | -3.184088237669054e+02 | -8.418510333285667e-11 | -5.294660586972117e-01 | PASS |
| spack_foss-2022a_serial_min | -3.184088237667331e+02 | 8.810729923425242e-11 | 5.541339574481284e-01 | PASS |
| spack_foss-2022a_mpi_min | -3.184088237669090e+02 | -8.776623872108757e-11 | -5.519889227741357e-01 | PASS |
| spack_foss-2022a_mpi_opt | -3.184088237668964e+02 | -7.514699973398820e-11 | -4.726226398364038e-01 | PASS |
| spack_foss-2022a_serial_opt | -3.184088237669067e+02 | -8.543565854779445e-11 | -5.373311858351852e-01 | PASS |
| spack_foss-2022a_serial_debug | -3.184088237667331e+02 | 8.810729923425242e-11 | 5.541339574481284e-01 | PASS |
| spack_foss-2023a_serial | -3.184088237667331e+02 | 8.810729923425242e-11 | 5.541339574481284e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -3.184088237669067e+02 | -8.549250196665525e-11 | -5.376886916141840e-01 | PASS |
| spack_foss-2023a_serial_omp | -3.184088237669073e+02 | -8.606093615526333e-11 | -5.412637494041720e-01 | PASS |
| spack_foss-2022a_mpi_debug | -3.184088237669087e+02 | -8.742517820792273e-11 | -5.498438881001430e-01 | PASS |
| spack_foss-2023a_serial_min | -3.184088237667331e+02 | 8.810729923425242e-11 | 5.541339574481284e-01 | PASS |
| spack_intel-2022a_serial_omp | -3.184088237669079e+02 | -8.662937034387141e-11 | -5.448388071941599e-01 | PASS |
| spack_intel-2023a_serial | -3.184088237668998e+02 | -7.861444828449748e-11 | -4.944304923553301e-01 | PASS |
| spack_intel-2023a_serial_omp | -3.184088237669043e+02 | -8.310507837450132e-11 | -5.226734488962347e-01 | PASS |
| spack_intel-2023a_impi | -3.184088237669073e+02 | -8.606093615526333e-11 | -5.412637494041720e-01 | PASS |
| spack_intel-2022a_impi_omp | -3.184088237669062e+02 | -8.492406777804717e-11 | -5.341136338241961e-01 | PASS |