Input 12-electronic_subsystem_propagators.03-aetrs.inp

Commits > Commit 3d047708c1ab8d71894fb240c9b3cff2ecebd198 > Run foss-ppc: [foss2022a-serial]

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060686608766757e+01 -1.060686608766760e+01 1.060000000000000e-13 3.197442310920451e-14 PASS
Energy [step 20] -1.060637197121567e+01 -1.060637197121568e+01 1.060000000000000e-13 1.421085471520200e-14 PASS
Multipoles [step 0] -7.736804971095363e-16 0.000000000000000e+00 5.000000000000000e-15 -7.736804971095363e-16 PASS
Multipoles [step 20] -1.265533510651934e-01 -1.265533510651940e-01 1.310000000000000e-14 6.106226635438361e-16 PASS
Compare to other inputs