New shades of photochromism - yellow sodalites for the detection of blue light

Abstract

The absorption energy of the F-center in photochromic sodalite can be lowered by expanding the unit cell with larger ions, changing the color from pink to blue. Blue-shifting this absorption to produce other colors is not so straightforward. In this work, sodalites of the formula Na2-2xCax(Na,K)(6)(AlSiO4)(6)(Cl,S)(2) displaying white-to-yellow photochromism have been prepared and thoroughly characterized. Combining spectroscopic experiments and quantum chemical calculations, the formation of a Na2Ca entity inside the sodalite cage surrounding the trapped electron responsible for the yellow color is postulated. Optimal yellow photochromism occurs for 0.13 <= x <= 0.18, while at x >= 0.27 the formation of the by-product davyne begins to affect the structure and optical properties. Finally, the sensitivity of these materials to blue light is shown to make them well-suited as sensors for blue light over-exposure e.g. from computer screens or smart phones.