Input 24-adsic_freeze_orbitals.01-gs.inp

Commits > Commit 7a2379c5947d58fb2522a5e1a0c4903dfa35a523 > Run spack_intel-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 -1.977413220000000e+00 -1.977413220000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
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