Input 12-absorption.03-td-restart.inp

Commits > Commit dbbd967b788cdda4a2df74a46ac2e5066a09d99b > Run foss-serial-min: [foss2022a-serial]

Matches

Name Value Reference Precision Difference Status
Energy [step 100] -5.809755909085657e+00 -5.809755909085682e+00 1.140000000000000e-13 2.486899575160351e-14 PASS
Energy [step 125] -5.809755894038673e+00 -5.809755894038739e+00 2.900000000000000e-13 6.572520305780927e-14 PASS
Energy [step 150] -5.809755872768426e+00 -5.809755872768485e+00 7.430000000000000e-14 5.950795411990839e-14 PASS
Energy [step 175] -5.809755859645711e+00 -5.809755859645770e+00 2.900000000000000e-13 5.861977570020827e-14 PASS
Energy [step 200] -5.809755837698922e+00 -5.809755837698980e+00 7.960000000000000e-14 5.773159728050814e-14 PASS
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