Input 03-xc.gga_x_wc.inp

Commits > Commit 49118372ba86b967cc9f5fccbbf24835f53b10d7 > Run spack_foss-2023a_serial_debug

Matches

Name Value Reference Precision Difference Status
gga_x_wc Eigenvalue up -9.615200000000000e-01 -9.614805000000000e-01 4.350000000000000e-05 -3.950000000008114e-05 PASS
gga_x_wc Eigenvalue dn -8.084630000000000e-01 -8.084249999999999e-01 4.070000000000000e-05 -3.800000000009351e-05 PASS
gga_x_wc Exchange -3.096181700000000e-01 -3.096147750000000e-01 3.760000000000000e-06 -3.395000000017134e-06 PASS
gga_x_wc Int[n*v_xc] -3.970087500000000e-01 -3.970044950000000e-01 4.700000000000000e-06 -4.255000000008557e-06 PASS
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