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

Commits > Commit b5086f89e5ba3598cb2c5ef57ca1b3f99761e498 > Run foss-mpi-min: [foss2023a-mpi]

Matches

Name Value Reference Precision Difference Status
Energy [step 100] -5.809755909086110e+00 -5.809755909086211e+00 2.900000000000000e-13 1.003641614261142e-13 PASS
Energy [step 125] -5.809755894039371e+00 -5.809755894039389e+00 9.530000000000000e-14 1.865174681370263e-14 PASS
Energy [step 150] -5.809755872769308e+00 -5.809755872769369e+00 7.380000000000000e-14 6.039613253960852e-14 PASS
Energy [step 175] -5.809755859646681e+00 -5.809755859646732e+00 1.020000000000000e-13 5.062616992290714e-14 PASS
Energy [step 200] -5.809755837700060e+00 -5.809755837700155e+00 1.100000000000000e-13 9.503509090791340e-14 PASS
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