Input 13-absorption-spin.01-gs.inp

Commits > Commit 8520a932a983b5c1584256e5aef0dad9a7dbc2f2 > Run spack_foss-2022a_serial_omp

Matches

Name Value Reference Precision Difference Status
SCF convergence 1.000000000000000e+00 1.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Initial energy -6.134127260000000e+00 -6.134127260000000e+00 3.070000000000000e-07 0.000000000000000e+00 PASS
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