Molecularly Encoded Quantum Materials (MolEQ): Chemistry-Driven Design of Quantum Matter

Name of applicant

Kasper Steen Pedersen

Title

Professor

Institution

Technical University of Denmark

Amount

DKK 12,997,628

Year

2025

Type of grant

Semper Ardens: Accomplish

What?

MolEQ will create a new class of quantum materials by embedding functional molecules directly inside layered two-dimensional crystals. These molecules are not passive guests but ordered, active components that control structure and program properties such as magnetism, valence, and quantum coherence, enabling unprecedented materials designed at the atomic scale.

Why?

Quantum materials promise breakthroughs in quantum computing, sensing, and energy, yet today they are almost exclusively built from a handful of simple crystals that cannot easily be modified. This severely restricts our ability to design materials with new behaviors. MolEQ changes this by using chemistry to deliberately encode functions and symmetries, unlocking a vast design space.

How?

MolEQ combines molecular design, synthesis, atomic-resolution electron crystallography, property characterization, and predictive modeling in a closed-loop discovery platform. This accelerates progress from idea to functional material, expanding the palette of quantum matter from a few dozen examples to an effectively unlimited library of molecule-crystal hybrids with transformative properties.

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