Match Energy [step 1]
Commits >
Commit 0a2b0bf36feedeffb58bf70ad5882092a0f43b8a >
Run cuda-mpi-omp: [foss2022a-cuda-mpi] >
Input 02-qd_2e_2d.02-td.inp
Value | Reference | Precision | Status |
3.915739296787769e+00 | 3.915739296788000e+00 | 1.000000000000000e-04 | PASS |
Command: LINEFIELD(td.general/energy, -101, 3)