22 -9 2 10 1.0 5.E-06 1.E-09-2 130 1.0 0.65 0.0 0.50 0.0 0.70 28 Ni2+ 3d8 2P06 3D08 28 Ni2+ 2p5 3d9 2P05 3D09 -1
28 Ni2+ 3d8 2P06 3D08 00028Positions 4 and 5 of each line indicate the atomic number of the element used in the calculation.
28 Ni2+ 3d8 2P06 3D08 xxxxNi2+ 3d8xxxxxxxxxxThe text 'Ni2+ 3d8' is a label to be associated with the configuration.
28 Ni2+ 3d8 2P06 3D08 c1xx c2xx c3xx c4xx c5xx c6xx c7xx c8xxThe final strings '2P06 3D08' specify the two shell configuration.
A continuum electron is indicated with the main quantum number 99, i.e. '2P05 3D0899S01' can be used as a final state in 2p photoemission.
Note that the specification of the atomic number 28, implies a
calculation for nickel. The configuration 2p6 3d8 implies that 26
electrons are assumed to be present: 1s2 2s2 2p6 3s2 3p6 = 18,
plus 8 3d electrons.
Hence the valency is Ni2+.