Input 05-forces.02-Na2_go.inp

Commits > Commit ab5faecb27d88076e64ba8608dc3fc5641398a04 > Run intel_omp_autotools: [intel2022a-serial]

Matches

Name Value Reference Precision Difference Status
SCF convergence 1.000000000000000e+00 1.000000000000000e+00 1.000000000000000e-01 0.000000000000000e+00 PASS
Total energy -3.599781000000000e-01 -3.599781000000000e-01 1.800000000000000e-06 0.000000000000000e+00 PASS
Force [1] -3.922076660000000e-04 -3.922076660000000e-04 1.960000000000000e-11 5.421010862427522e-20 PASS
Force [2] 3.922076660000000e-04 3.922076660000000e-04 1.960000000000000e-11 -5.421010862427522e-20 PASS
Geometry [1] -1.380886000000000e+00 -1.380886000000000e+00 6.900000000000000e-06 0.000000000000000e+00 PASS
Geometry [2] 1.380886000000000e+00 1.380886000000000e+00 6.900000000000000e-06 0.000000000000000e+00 PASS
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