Input 04-octopus_basics-visualization.01-benzene.inp

Commits > Commit e0b7240ece6c1278a2610f2d337090ca4d2c526d > Run spack_foss-2023b_serial

Matches

Name Value Reference Precision Difference Status
SCF convergence 1.000000000000000e+00 1.000000000000000e+00 5.000000000000000e-02 0.000000000000000e+00 PASS
Total Energy -9.937199346800001e+02 -9.936904111000000e+02 3.250000000000000e-02 -2.952358000004551e-02 PASS
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