Match Multipoles [step 0]
Commits >
Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] >
Input 14-fullerene_unpacked.02-td-unpacked.inp
Value | Reference | Precision | Status |
-1.208173934630255e-03 | -1.211520628226222e-03 | 8.480000000000000e-06 | PASS |
Command: LINEFIELD(td.general/multipoles, -21, 4)