Input 03-xc.gga_x_pbe_jsjr.inp

Commits > Commit 17b096911440bfe83ad69af07734b73ecc024f80 > Run spack_foss-2022a_cuda_serial

Matches

Name Value Reference Precision Difference Status
gga_x_pbe_jsjr Eigenvalue up -9.579370000000000e-01 -9.579770000000001e-01 4.400000000000000e-05 4.000000000004000e-05 PASS
gga_x_pbe_jsjr Eigenvalue dn -8.066220000000000e-01 -8.066590000000000e-01 4.070000000000000e-05 3.700000000006476e-05 PASS
gga_x_pbe_jsjr Exchange -3.072045100000000e-01 -3.072079250000000e-01 3.750000000000000e-06 3.415000000006607e-06 PASS
gga_x_pbe_jsjr Int[n*v_xc] -3.938444200000000e-01 -3.938486600000000e-01 4.640000000000000e-06 4.240000000044208e-06 PASS
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