Input 03-xc.gga_x_optb88_vdw.inp

Commits > Commit 9cd8be12b3755ae83838647d0fe27e1f4e47031c > Run foss-2022a_ppc

Matches

Name Value Reference Precision Difference Status
gga_x_optb88_vdw Eigenvalue up -9.636260000000000e-01 -9.635860000000001e-01 4.400000000000000e-05 -3.999999999992898e-05 PASS
gga_x_optb88_vdw Eigenvalue dn -8.123560000000000e-01 -8.123184999999999e-01 4.120000000000000e-05 -3.750000000002363e-05 PASS
gga_x_optb88_vdw Exchange -3.141832400000000e-01 -3.141797550000000e-01 3.840000000000000e-06 -3.484999999969762e-06 PASS
gga_x_optb88_vdw Int[n*v_xc] -3.994721900000000e-01 -3.994679000000000e-01 4.740000000000000e-06 -4.290000000017891e-06 PASS
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