Table 2. Same as Table 1 ▸ with non-interpolated data but using experimental uncertainties in determining the fit.
| i-pr Ni | n-pr Ni | |
|---|---|---|
|
1.094 ± 0.025 | 0.788 ± 0.028 |
| α | 1.0008 ± 0.0032 | 1.0261 ±0.0062 |
, (Å2)†
|
0.0010‡ | 0.0010‡ |
(Å2)§
|
0.0020‡ | 0.0020‡ |
(Å2) |
0.0048 ± 0.0023 | 0.0064 ± 0.0044 |
(eV) |
0.85 ± 0.72 | 6.70 ± 1.11 |
|
5.905 | 9.576 |
|
+0.004 | −0.117 |
and
are for the two-legged Ni—N—Ni and Ni—O—Ni paths, set to 0.001 Å2.
Fixed to physical value.
is the thermal broadening parameter for the next shortest 15 photoelectron scattering FEFF paths, set to be 0.002 Å2.




