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Discovering new deep ultraviolet (DUV) nonlinear optical (NLO) materials is the current research hotspot. However, how to perfectly integrate several stringent performances into a crystal is a great challenge because of the natural incompatibility among them, particularly wide band gap and large NLO coefficient. To tackle the challenge, a boron‐rich closed‐loop strategy is supposed, based on which...
The first examples of thioborate‐thiosilicates, namely Ca2Ln(BS3)(SiS4) (Ln = La, Ce, and Gd), are synthesized by rationally designed high‐temperature solid‐state reactions. They crystalize in the polar space group P63mc and feature a novel three‐dimensional crystal structure in which the discrete [BS3]3− and [SiS4]4− anionic groups are linked by Ca2+ and Ln3+ cations occupying the same atomic site...
Second‐harmonic generation (SHG) response and birefringence are crucial properties for linear and nonlinear optical (NLO) materials, while it is difficult to further optimize these two key properties by using a single traditional functional building block (FBB) in one compound. Herein, a novel IO45− unit is identified, which possesses a square‐planar configuration and two stereochemically active lone‐pairs...
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