ArticleACS omega2026
Crystal-Field Effects on Dipole Moments and Static First Hyperpolarizability in Noncentrosymmetric Ionic Organic Crystals.
Article in ACS omega, 2026. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Not yet cited in PubMed.
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4 authors.
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Abstract
Understanding how crystal fields modify local nonlinear optical responses is essential for the rational design of acentric ionic organic crystals. Here, we investigate a structurally diverse set of noncentrosymmetric push-pull ionic crystals, including classical stilbazolium benchmarks and 6MNEP-related GUR/GUS crystals identified by their CCDC refcodes, to evaluate how electrostatic embedding affects the dipole moment and total static first hyperpolarizability (β
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