Table 3.
Summary of the properties of the Mo x-ray absorption edges. The nominal energy refers to elemental Mo. The Mo partial cross sections are derived from the ENDF/B evaluated nuclear data library [50] and refer to the specific Mo sub-shell only. The fluorescence yield and natural linewidths are determined from published values using the cited references. The observed linewidth is that determined for MoO42- and MoS42- pre-edge structures as described in the text. The chemical shift is the energy difference of the MoO42- and MoS42- pre-edge structure centroids determined in this work.
| Edge | Nominal Energy (eV) | Mo Partial Absorption Cross section σ (cm2/g) | O Total Cross section σ (cm2/g) | Fluorescence Yield ω | Natural Linewidth Γ (eV) | Observed Linewidth Γobs (eV) | Chemical Shift Δ (eV) | Natural Δ/Γ | Observed Δ/Γobs | ||
|---|---|---|---|---|---|---|---|---|---|---|---|
| K (1s) | 20000.4 | 67.5 | 0.603 | 0.765 | 85.6 | 4.52 | 5.5 | 3.70 | 0.82 | 0.67 | |
| L1 (2s) | 2865.5 | 287 | 247 | 0.010 | 1.16E-02 | 3.80 | |||||
| L2 (2p1/2) | 2625.1 | 669 | 317 | 0.034 | 7.18E-02 | 1.83 | 2.2 | 2.40 | 1.31 | 1.09 | |
| L3 (2p3/2) | 2520.2 | 1410 | 396 | 0.037 | 0.132 | 1.69 | 2.2 | 2.35 | 1.39 | 1.07 | |
| M1 (3s) | 506.3 | 872 | 1430 | 3.6 × 10-3 | 2.19E-03 | 6.3 | |||||
| M2 (3p1/2) | 411.6 | 957 | 2380 | 2.0 × 10-4 | 8.05E-05 | 2.1 | 2.2 | 2.08 | 0.99 | 0.95 | |
| M3 (3p3/2) | 394.0 | 2460 | 2680 | 1.9 × 10-4 | 1.75E-04 | 2.1 | 2.2 | 2.25 | 1.07 | 1.02 | |
| M4 (3d3/2) | 231.1 | 630 | 9810 | 3.5 × 10-3 | 2.25E-04 | 0.22 | 0.43 | 2.64 | 12.0 | 6.14 | |
| M5 (3d5/2) | 227.9 | 904 | 1.01 × 104 | 3.5 × 10-3 | 3.13E-04 | 0.12 | 0.40 | 2.54 | 21.2 | 6.35 | |
| Reference | [53, 54] | [50] | [50] | [14, 15, 51, 52] | [13] | This work | This work |