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Encoding hierarchical 3D architecture through inverse design of programmable bonds

Jason S. Kahn, Brian Minevich, Aaron Michelson, Hamed Emamy, Jiahao Wu, Huajian Ji, Alexia Yun, Kim Kisslinger, Shuting Xiang, Nanfang Yu, Sanat K. Kumar, Oleg Gang

2025Nature Materials17 citationsDOIOpen Access PDF

Abstract

The ability to fabricate materials and devices at small scales by design has resulted in tremendous technological progress. However, the need for engineered three-dimensional (3D) nanoscale materials requires new strategies for organizing nanocomponents. Here we demonstrate an inverse design approach for the assembly of nanoparticles into hierarchically ordered 3D organizations using DNA voxels with directional, addressable bonds. By identifying intrinsic symmetries in repeating mesoscale structural motifs, we prescribe a set of voxels, termed a mesovoxel, that are assembled into target 3D crystals. The relationship between different degrees of encoded information used for voxel bonds and the fidelity of assembly is investigated using experimental and computational methods. We apply this assembly strategy to create periodic 3D nanoparticle ordered organizations, including structures with low-dimensional elements, helical motifs, a nanoscale analogue of a face-centred perovskite crystal and a distributed Bragg reflector based on a crystal with plasmonic and photonic length-scale regimes.

Topics & Concepts

Materials scienceNanotechnologyVoxelNanoscopic scaleNanophotonicsPlasmonTetrahedronPhotonic crystalPhotonicsComputer scienceOptoelectronicsCrystallographyChemistryArtificial intelligenceAdvanced biosensing and bioanalysis techniquesSupramolecular Self-Assembly in MaterialsPhotonic Crystals and Applications
Encoding hierarchical 3D architecture through inverse design of programmable bonds | Litcius