Input 03-xc.gga_x_b86_mgc.inp

Commits > Commit 3f59639a2c09960e9ce8b923e2789a20396f5ecf > Run spack_foss-2022a_serial_min

Matches

Name Value Reference Precision Difference Status
gga_x_b86_mgc Eigenvalue up -9.711620000000000e-01 -9.711220000000000e-01 4.400000000000000e-05 -3.999999999992898e-05 PASS
gga_x_b86_mgc Eigenvalue dn -8.191560000000000e-01 -8.191180000000000e-01 4.180000000000000e-05 -3.799999999998249e-05 PASS
gga_x_b86_mgc Exchange -3.202742200000000e-01 -3.202705900000000e-01 4.010000000000000e-06 -3.629999999976707e-06 PASS
gga_x_b86_mgc Int[n*v_xc] -4.068609300000000e-01 -4.068564700000000e-01 4.930000000000000e-06 -4.459999999983921e-06 PASS
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