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arXiv:2603.28270 · Physica Scripta

Quantum engineering with ultracold polar molecules using trap-induced resonances

Sakthikumaran Ravichandran, Piotr Kulik, Krzysztof Jachymski

physics.atom-phcond-mat.quant-gasquant-phSubmitted Mar 30, 2026• Announced Mar 31, 2026• 0 citations
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Abstract

Polar molecules represent a promising platform for quantum simulation and computation protocols. Highly controllable arrays of optical tweezers are now accessible in experiments, allowing for unprecedented control of individual molecules. Motional dephasing is typically seen as an obstacle in quantum computing scenarios. Here, we instead consider using the trap structure as a resource for implementing efficient quantum gates. By numerically solving the two-body problem of dipoles trapped in separate tweezers, we identify trap-induced resonances that can serve as the mechanism for achieving state-dependent dynamics and can be further utilized for quantum sensing.

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Polar molecules represent a promising platform for quantum simulation and computation protocols. Highly controllable arrays of optical tweezers are now accessible in experiments, allowing for unprecedented control of individual molecules. Motional dephasing is typically seen as an obstacle in quantum computing scenarios. Here, we instead consider using the trap structure as a resource for implementing efficient quantum gates. By numerically solving the two-body problem of dipoles trapped in separate tweezers, we identify trap-induced resonances that can serve as the mechanism for achieving state-dependent dynamics and can be further utilized for quantum sensing.
Abstract Ultracold molecules trapped in optical tweezers show great promise for the implementation of quantum technologies and precision measurements. We study a prototypical scenario where two interacting polar molecules placed in separate traps are controlled using an external electric field. This, for instance, enables a quantum computing scheme in which the rotational structure is used to encode the qubit states. We estimate the typical operation timescales needed for state engineering to be in the range of few microseconds. We further underline the important role of the spatial structure of the two-body states, with the potential for significant gate speedup employing trap-induced resonances.
The ability to control particles in the quantum regime at the individual particle level is a challenge at the frontier of quantum science and engineering. Of the many quantum objects developed in pursuit of this goal, ultracold molecules host rich internal states and unique inter-particle interactions that could lend themselves useful to a broad range of applications including quantum computing and simulation, precision measurements and quantum chemistry. In this thesis we present a bottom-up approach to creating single molecules in individual optical tweezers. In particular, single atoms of two different species are first trapped and cooled in individual optical tweezers then brought together to form a single molecule coherently. Using this approach, we have successfully created an array of fully quantum-state-controlled polar molecules. The quantum state – including both internal and external states – of the resulting molecules are known to us, and is the first time single neutral molecules have been under full quantum state control. This platform offers exciting new opportunities to harness the rich properties of molecules in many quantum science applications.
Optically trapped ultracold polar molecules can have multiple long-lived states for coding quantum information, and can exhibit electric dipole-dipole interactions~(DDI) which enables entanglement generation. The general understanding on the quantized motion~(QM) of molecules in the traps is that it causes fluctuation of DDI. Here, we find that the molecular QM can realize an asymmetric quantum Rabi model, which is of specific importance in the study of fundamental physics. The molecular QM can also lead to an exotic trap-dipole resonance, resulting in excess population loss to uncoupled motional states, and, hence, should be avoided in a general quantum control over polar molecules. To examine the impact of QM on quantum computing based on polar molecules, we introduce two gate protocols, a fast iSWAP gate which can be realized by a global microwave pulse of pulse area smaller than 2π2π2π, and a controlled-phase gate with an arbitrary controlled phase, and find that both gates can attain a high fidelity.
Fully internal and motional state controlled and individually manipulable polar molecules are desirable for many quantum science applications leveraging the rich state space and intrinsic interactions of molecules. While prior efforts at assembling molecules from their constituent atoms individually trapped in optical tweezers achieved such a goal for exactly one molecule, here we extend the technique to an array of five molecules, unlocking the ability to study molecular interactions. We detail the technical challenges and solutions inherent in scaling this system up. With parallel preparation and control of multiple molecules in hand, this platform now serves as a starting point to harness the vast resources and long-range dipolar interactions of molecules.
Abstract Fully internal and motional state controlled and individually manipulable polar molecules are desirable for many quantum science applications leveraging the rich state space and intrinsic interactions of molecules. While prior efforts at assembling molecules from their constituent atoms individually trapped in optical tweezers achieved such a goal for exactly one molecule (Zhang J T et al 2020 Phys. Rev. Lett. 124 253401; Cairncross W B et al 2021 Phys. Rev. Lett. 126 123402; He X et al 2020 Science 370 331–5), here we extend the technique to an array of five molecules, unlocking the ability to study molecular interactions. We detail the technical challenges and solutions inherent in scaling this system up. With parallel preparation and control of multiple molecules in hand, this platform now serves as a starting point to harness the vast resources and long-range dipolar interactions of molecules.
Ultracold molecules are attractive candidates for various applications including ultracold chemistry, quantum information processing, quantum simulation and searches for physics beyond the standard model. Combined with optical tweezer techniques, an optical tweezer array of ultracold polar molecules holds promise for versatile quantum applications. Their long-lived molecular rotational states form robust qubits, while the long-range dipolar interaction between molecules provides quantum entanglement. In this thesis, we build a new generation experiment of optical tweezer array of ultracold CaF molecules. We optically transport the laser cooled and optically trapped molecules into a science glass cell using a hybrid method, where high numerical aperture optical access allows for tighter optical tweezers. In an array of these tight optical tweezers, we demonstrate dipolar spin-exchange interactions between single CaF molecules for the first time. We realize the spin-12\frac{1}{2}21​ quantum XY model by encoding an effective spin-12\frac{1}{2}21​ system into the rotational states of the molecules, and use it to generate a Bell state through an iSWAP operation. Conditioned on the verified existence of molecules in both tweezers at the end of the measurement, we obtain a Bell state fidelity of 0.89(6). Employing interleaved tweezer arrays, we demonstrate single site molecular addressability. To further improve the platform, cooling of the molecules to near the motional ground state is crucial for reducing various dephasings. We demonstrate Raman sideband cooling (RSC) of CaF molecules in optical tweezers to near their 3-D motional ground state, with a 3-D motional ground state probability of 54±18%54\pm18\%54±18% of the molecules that survive the RSC. This paves the way to increase molecular coherence times in optical tweezers for robust quantum information processing and simulation applications in the near future.