Input 08-constrain.03-polarized.inp

Commits > Commit adc9f2ea8065b70b337db7e35c2a67771b9e5a60 > Run foss-mpi-opt-full: [foss2023a-mpi]

Matches

Name Value Reference Precision Difference Status
SCF convergence 1.000000000000000e+00 1.000000000000000e+00 5.100000000000000e-05 0.000000000000000e+00 PASS
Total Magnetic Moment - z -1.000000000000000e+00 -1.000000000000000e+00 5.100000000000000e-05 0.000000000000000e+00 PASS
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