Input 03-xc.sic_pz.inp

Commits > Commit 45adf9b0e5ec0c590d65885bc40efffc0d377767 > Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi]

Matches

Name Value Reference Precision Difference Status
OEP SIC Eigenvalue up -1.196070000000000e+00 -1.196074000000000e+00 5.980000000000000e-06 4.000000000115023e-06 PASS
OEP SIC Eigenvalue dn -9.024050000000000e-01 -9.024380000000000e-01 4.510000000000000e-05 3.299999999994974e-05 PASS
OEP SIC Exchange -3.236236300000000e-01 -3.236058600000000e-01 1.950000000000000e-05 -1.776999999997253e-05 PASS
OEP SIC Correlation -1.372656000000000e-02 -1.372682000000000e-02 2.860000000000000e-07 2.600000000001906e-07 PASS
OEP SIC Int[n*v_xc] -6.035068400000000e-01 -6.034819300000001e-01 2.740000000000000e-05 -2.490999999993360e-05 PASS
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