Input 12-electronic_subsystem_propagators.02-expmid.inp

Commits > Commit 08b73ec86c1ce3969ff61040f8f54a592910f9b6 > Run spack_foss-2023a_valgrind

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060684240205382e+01 -1.060684240205380e+01 5.300000000000000e-14 -1.776356839400250e-14 PASS
Energy [step 20] -1.060645465229319e+01 -1.060645465229320e+01 5.300000000000000e-13 8.881784197001252e-15 PASS
Multipoles [step 0] -2.549972562206244e-16 6.744248104320451e-16 4.500000000000000e-15 -9.294220666526696e-16 PASS
Multipoles [step 20] -1.108552941390298e-01 -1.108552941390270e-01 5.540000000000000e-15 -2.803313137178520e-15 PASS
Compare to other inputs