By Ian Scheffler, University of Pennsylvania School of Engineering and Applied Science January 8, 2025

Collected at; https://scitechdaily.com/revolutionary-quantum-tech-lets-scientists-see-the-sub-atomic-world/

In a significant scientific breakthrough, engineers at Penn Engineering have developed a refined form of nuclear quadrupolar resonance spectroscopy that can detect signals from individual atoms.

This advanced technique could revolutionize fields like drug development by enabling scientists to examine molecular interactions at the atomic level, potentially leading to major advancements in understanding diseases and creating new medications.

Revolutionary Quantum Sensing

Since the 1950s, scientists have used radio waves to identify the molecular “fingerprints” of various materials. This technology has powered innovations as diverse as MRI scans for medical diagnostics and explosive detection systems at airports.

However, these methods rely on signals averaged from trillions of atoms, making it impossible to observe subtle variations between individual molecules. This limitation is particularly challenging in fields like protein research, where tiny differences in molecular structure can determine whether a protein promotes health or causes disease.

Sub-Atomic Insights

Now, researchers at the University of Pennsylvania’s School of Engineering and Applied Science (Penn Engineering) have taken a major step forward. Using quantum sensors, they have developed a groundbreaking variation of nuclear quadrupolar resonance (NQR) spectroscopy — a technique traditionally employed to detect drugs, explosives, and analyze pharmaceuticals.

As described in Nano Letters, the new method is so precise that it can detect the NQR signals from individual atoms — a feat once thought unattainable. This unprecedented sensitivity opens the door to breakthroughs in fields like drug development, where understanding molecular interactions at the atomic level is critical.

“This technique allows us to isolate individual nuclei and reveal tiny differences in what were thought to be identical molecules,” says Lee Bassett, Associate Professor in Electrical and Systems Engineering (ESE), Director of Penn’s Quantum Engineering Laboratory (QEL) and the paper’s senior author. “By focusing on a single nucleus, we can uncover details about molecular structure and dynamics that were previously hidden. This capability allows us to study the building blocks of the natural world at an entirely new scale.”

An Unexpected Discovery

The discovery stemmed from an unexpected observation during routine experiments. Alex Breitweiser, a recent doctoral graduate in Physics from Penn’s School of Arts & Sciences and the paper’s co-first author, who is now a researcher at IBM, was working with nitrogen-vacancy (NV) centers in diamonds — atomic-scale defects often used in quantum sensing — when he noticed unusual patterns in the data.

The periodic signals looked like an experimental artifact, but persisted after extensive troubleshooting. Returning to textbooks from the 1950s and ‘60s on nuclear magnetic resonance, Breitweiser identified a physical mechanism that explained what they were seeing, but that had previously been dismissed as experimentally insignificant.

Advances in technology allowed the team to detect and measure effects that were once beyond the reach of scientific instruments. “We realized we weren’t just seeing an anomaly,” Brietweiser says. “We were breaking into a new regime of physics that we can access with this technology.”

Pioneering Single-Atom Detection

Understanding of the effect was further developed through collaboration with researchers at Delft University of Technology in the Netherlands, where Breitweiser had spent time conducting research on related topics as part of an international fellowship. Combining expertise in experimental physics, quantum sensing and theoretical modeling, the team created a method capable of capturing single atomic signals with extraordinary precision.

“This is a bit like isolating a single row in a huge spreadsheet,” explains Mathieu Ouellet, a recent ESE doctoral graduate and the paper’s other co-first author. “Traditional NQR produces something like an average — you get a sense of the data as a whole, but know nothing about the individual data points. With this method, it’s as though we’ve uncovered all the data behind the average, isolating the signal from one nucleus and revealing its unique properties.”

Deciphering the Signals

Determining the theoretical underpinnings of the unexpected experimental result took significant effort. Ouellet had to carefully test various hypotheses, running simulations and performing calculations to match the data with potential causes. “It’s a bit like diagnosing a patient based on symptoms,” he explains. “The data points to something unusual, but there are often multiple possible explanations. It took quite a while to arrive at the correct diagnosis.”

Looking ahead, the researchers see vast potential for their method to address pressing scientific challenges. By characterizing phenomena that were previously hidden, the new method could help scientists better understand the molecular mechanisms that shape our world.

Reference: “Quadrupolar Resonance Spectroscopy of Individual Nuclei Using a Room-Temperature Quantum Sensor” by S. Alex Breitweiser, Mathieu Ouellet, Tzu-Yung Huang, Tim H. Taminiau and Lee C. Bassett, 12 December 2024, Nano Letters.
DOI: 10.1021/acs.nanolett.4c04112

This study was conducted at the University of Pennsylvania School of Engineering and Applied Science and supported by the National Science Foundation (ECCS-1842655, DMR-2019444). Additional support came from the Natural Sciences and Engineering Research Council of Canada, through a Ph.D. Fellowship awarded to Ouellet, and from IBM, through a Ph.D. Fellowship awarded to Breitweiser.

Additional co-authors include Tzu-Yung Huang, formerly a doctoral student in ESE within Penn Engineering, now of Nokia Bell Labs, and Tim H. Taminiau at Delft University of Technology.

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