Complex

εnadd

O2−

F

O2−

F

O2−

F

O2−

F

O2−

F

ON∙Pd∙MgO

−2.749

−3.888

−1.238

−3.188

−0.061

−0.092

−1.229

−1.128

−0.221

0.519

ON∙Rh∙MgO

−4.892

−4.713

−1.294

−2.938

−0.086

−0.080

−2.570

−2.537

−0.942

0.842

ON∙Pd2∙MgO

−5.489

−6.847

−3.624

−5.614

0.035

−0.068

−3.529

−2.659

1.629

1.494

ON∙Rh2∙MgO

−5.989

−7.846

−3.058

−4.870

−0.063

−0.120

−2.528

−2.528

−0.341

−0.328

ON∙PdRh∙MgO

−5.704

−7.600

−3.039

−4.727

−0.062

−0.117

−2.638

−2.619

0.035

−0.136