Input 07-mgga.03-tb09_td.inp

Commits > Commit 61d12a07bb2f18211cbe349e5d87c7e10e0bf297 > Run foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi]

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -4.657566324809614e+01 -4.647906570762484e+01 1.060000000000000e-01 -9.659754047130065e-02 PASS
Energy [step 5] -4.657612931583586e+01 -4.657612926021354e+01 6.120000000000001e-08 -5.562232274769485e-08 PASS
Energy [step 10] -4.657642748315606e+01 -4.657642785019272e+01 4.040000000000000e-07 3.670366623964583e-07 PASS
Energy [step 15] -4.657647547962921e+01 -4.657647517359855e+01 3.370000000000000e-07 -3.060306568158921e-07 PASS
Energy [step 20] -4.657643789745949e+01 -4.657643693274203e+01 1.060000000000000e-06 -9.647174579185958e-07 PASS
Vector potential [step 1] 1.000000000000000e+01 1.000000000000000e+01 1.000000000000000e-01 0.000000000000000e+00 PASS
Vector potential [step 5] 9.928666877224666e+00 9.928666877256525e+00 6.149999999999999e-11 -3.185895991464349e-11 PASS
Vector potential [step 10] 9.721533213323610e+00 9.721533213603040e+00 5.030000000000000e-10 -2.794298126218564e-10 PASS
Vector potential [step 15] 9.393406286796504e+00 9.393406287717600e+00 1.720000000000000e-09 -9.210960882910513e-10 PASS
Vector potential [step 20] 8.957517423929547e+00 8.957517424000001e+00 4.480000000000000e-08 -7.045386496429273e-11 PASS
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