 | Acta Crystallographica Section B Acta Crystallographica Section B STRUCTURAL SCIENCE, CRYSTAL ENGINEERING AND MATERIALS |
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![[Figure 10]](xk5054fig10mag.jpg)
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Figure 10
The changes in the electronic structure of PA with increasing pressure. (a) Predicted shrinking of the HOCO–LUCO band gap; the bars represent band gap extent; the colors approximate the expected sample color at a given pressure. (b) Microscopy images of a PA crystal in a DAC (gasket diameter ∼400 µm, taken from ca 0.01 GPa to ca 5.0 GPa at regular intervals of ∼0.45 GPa; gradual darkening of the sample indicates a change in the solid-state absorption spectrum. (c) Calculated electronic density of states and band structure plots for PA in the vicinity of HOCO–LUCO band gap: without external pressure (left), at 3 GPa (middle) and at 10 GPa (right). |
![[Figure 10]](xk5054fig10.jpg)
| STRUCTURAL SCIENCE CRYSTAL ENGINEERING MATERIALS |
ISSN: 2052-5206
