Input 12-electronic_subsystem_propagators.03-aetrs.inp

Commits > Commit 18848dd43b1805cec78813204483223eec09e06c > Run foss_mpi_autotools: [foss2023a-mpi]

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060686608766763e+01 -1.060686608766760e+01 1.060000000000000e-13 -3.197442310920451e-14 PASS
Energy [step 20] -1.060637197121569e+01 -1.060637197121568e+01 1.060000000000000e-13 -5.329070518200751e-15 PASS
Multipoles [step 0] -9.533494599225229e-16 0.000000000000000e+00 5.000000000000000e-15 -9.533494599225229e-16 PASS
Multipoles [step 20] -1.265533510652060e-01 -1.265533510651940e-01 1.310000000000000e-14 -1.196265309033606e-14 PASS
Compare to other inputs