Input 12-electronic_subsystem_propagators.03-aetrs.inp

Commits > Commit 3186a8a51be7ad5a27ccff6e8e2901df0a16a559 > Run spack_foss-2023a_serial_omp

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060686608766763e+01 -1.060686608766760e+01 1.060000000000000e-13 -2.842170943040401e-14 PASS
Energy [step 20] -1.060637197121569e+01 -1.060637197121568e+01 1.060000000000000e-13 -8.881784197001252e-15 PASS
Multipoles [step 0] 1.185176956575162e-15 0.000000000000000e+00 5.000000000000000e-15 1.185176956575162e-15 PASS
Multipoles [step 20] -1.265533510652013e-01 -1.265533510652018e-01 3.540000000000000e-15 4.718447854656915e-16 PASS
Compare to other inputs