Synthesis-by-design
Predictive design rules for extended solids
In molecular chemistry, retrosynthesis succeeds because well-defined fragments assemble under precise kinetic control. Extended inorganic solids present a fundamentally different challenge: their formation is typically driven by bulk thermodynamics, masking the underlying reaction pathways. We are bridging this gap by applying molecular logic to solid-state synthesis.
By utilizing high-temperature molten fluxes as actively reactive media, we depolymerize extended solids into discrete, solvated clusters. Systematically tuning the basicity, temperature, and composition of these fluxes allows us to control the speciation of transient inorganic building blocks. As we track the evolution of these species from isolated motifs to extended macroscopic networks, we directly link solution-state conditions to final crystal topologies. Ultimately, by uncovering how specific coordination environments imprint themselves onto extended materials, we are writing the predictive design rules for solid-state synthesis.
Representative papers: JACS 2025; Angew. Chem. 2023; Nature 2022.