Match comparison for Energy [step 20] (match type 12076)
Commits >
Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 >
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 | -3.184088237668857e+02 | 5.405397021431145e-11 | -3.184088237668217e+02 | 8.856204658513889e-11 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: -318.40882376682123, precision: 0.000000000159| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | -3.184088237669067e+02 | -8.543565854779445e-11 | -5.373311858351852e-01 | PASS |
| spack_foss-2022a_serial_min | -3.184088237667331e+02 | 8.810729923425242e-11 | 5.541339574481284e-01 | PASS |
| foss-2022a_ppc | -3.184088237669082e+02 | -8.697043085703626e-11 | -5.469838418681526e-01 | PASS |
| spack_foss-2022a_serial_opt | -3.184088237669067e+02 | -8.543565854779445e-11 | -5.373311858351852e-01 | PASS |
| spack_foss-2022a_serial | -3.184088237667331e+02 | 8.810729923425242e-11 | 5.541339574481284e-01 | PASS |
| foss-2022a_opt | -3.184088237669023e+02 | -8.105871529551223e-11 | -5.098032408522782e-01 | PASS |
| intel-2022b | -3.184088237669037e+02 | -8.242295734817162e-11 | -5.183833795482492e-01 | PASS |
| intel-2022a | -3.184088237669037e+02 | -8.242295734817162e-11 | -5.183833795482492e-01 | PASS |
| spack_foss-2022a_serial_omp | -3.184088237669064e+02 | -8.515144145349041e-11 | -5.355436569401912e-01 | PASS |
| cmake_foss_2022a_full_mpi | -3.184088237668939e+02 | -7.270273272297345e-11 | -4.572498913394557e-01 | PASS |
| spack_foss-2022a_serial_debug | -3.184088237667331e+02 | 8.810729923425242e-11 | 5.541339574481284e-01 | PASS |
| foss-2022a_omp | -3.184088237669043e+02 | -8.304823495564051e-11 | -5.223159431172359e-01 | PASS |
| intel-2022a_omp | -3.184088237669050e+02 | -8.373035598197021e-11 | -5.266060124652214e-01 | PASS |
| intel-2022b_impi | -3.184088237669039e+02 | -8.265033102361485e-11 | -5.198134026642444e-01 | PASS |
| intel-2022a_impi | -3.184088237668997e+02 | -7.844391802791506e-11 | -4.933579750183337e-01 | PASS |
| eb_fosscuda-2022a_mpi_omp | -3.184088237669031e+02 | -8.185452315956354e-11 | -5.148083217582613e-01 | PASS |
| eb_fosscuda-2022a | -3.184088237669058e+02 | -8.458300726488233e-11 | -5.319685991502033e-01 | PASS |
| cmake_foss_2022a_min_serial | -3.184088237669067e+02 | -8.543565854779445e-11 | -5.373311858351852e-01 | PASS |
| foss-2022a_mpi_omp | -3.184088237669077e+02 | -8.651568350614980e-11 | -5.441237956361623e-01 | PASS |
| cmake_foss_2022a_min_mpi | -3.184088237669048e+02 | -8.355982572538778e-11 | -5.255334951282251e-01 | PASS |
| eb_foss-2022a | -3.184088237669017e+02 | -8.049028110690415e-11 | -5.062281830622902e-01 | PASS |
| eb_foss-2022b_libxc6 | -3.184088237669022e+02 | -8.100187187665142e-11 | -5.094457350732794e-01 | PASS |
| eb_foss-2022a_debug | -3.184088237669017e+02 | -8.049028110690415e-11 | -5.062281830622902e-01 | PASS |
| intel-2022a_omp_impi | -3.184088237669102e+02 | -8.901679393602535e-11 | -5.598540499121092e-01 | PASS |
| eb_foss-2022a_mpi | -3.184088237669093e+02 | -8.810729923425242e-11 | -5.541339574481284e-01 | PASS |
| eb_foss-2022b_libxc6_mpi | -3.184088237669080e+02 | -8.679990060045384e-11 | -5.459113245311562e-01 | PASS |
| eb_foss-2022a_mpi_debug | -3.184088237669094e+02 | -8.822098607197404e-11 | -5.548489690061260e-01 | PASS |