Input 19-qedft-breit-1d.01-etac-px.inp

Commits > Commit 85779d3dd9ec6e18544835020e079bae8c405b87 > Run spack_foss-2023a_valgrind

Matches

Name Value Reference Precision Difference Status
SCF convergence 1.000000000000000e+00 1.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Total Energy 1.113353330000000e+00 1.113353330000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Eigenvalues energy 5.915798200000000e-01 5.915800000000000e-01 1.000000000000000e-04 -1.800000000162782e-07 PASS
Photon exchange 6.062648000000000e-01 6.062648000000000e-01 1.000000000000000e-04 0.000000000000000e+00 PASS
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