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Getting something for nothing doesnt work in physics. But it turns out that, by thinking like a strategic gamer, and with some help from a demon, improved energy efficiency for complex systems like data centers might be possible.

In computer simulations, Stephen Whitelam of the Department of Energys Lawrence Berkeley National Laboratory (Berkeley Lab) used neural networks (a type of machine learning model that mimics human brain processes) to train nanosystems, which are tiny machines about the size of molecules, to work with greater energy efficiency.

Whats more, the simulations showed that learned protocols could draw heat from the systems by virtue of constantly measuring them to find the most energy efficient operations.

We can get energy out of the system, or we can store work in the system, Whitelam said.

Its an insight that could prove valuable, for example, in operating very large systems like computer data centers. Banks of computers produce enormous amounts of heat that must be extracted using still more energy to prevent damage to the sensitive electronics.

We can get energy out of the system, or we can store work in the system.

Stephen Whitelam

Whitelam conducted the research at the Molecular Foundry, a DOE Office of Science user facility at Berkeley Lab. His work is described in a paper published in Physical Review X.

Asked about the origin of his ideas, Whitelam said, People had used techniques in the machine learning literature to play Atari video games that seemed naturally suited to materials science.

In a video game like Pac Man, he explained, the aim with machine learning would be to choose a particular time for an action up, down, left, right, and so on to be performed. Over time, the machine learning algorithms will learn the best moves to make, and when, to achieve high scores. The same algorithms can work for nanoscale systems.

Whitelams simulations are also something of an answer to an old thought experiment in physics called Maxwells Demon. Briefly, in 1867, physicist James Clerk Maxwell proposed a box filled with a gas, and in the middle of the box there would be a massless demon controlling a trap door. The demon would open the door to allow faster molecules of the gas to move to one side of the box and slower molecules to the opposite side.

Eventually, with all molecules so segregated, the slow side of the box would be cold and the fast side would be hot, matching the energy of the molecules.

The system would constitute a heat engine, Whitelam said. Importantly, however, Maxwells Demon doesnt violate the laws of thermodynamics getting something for nothing because information is equivalent to energy. Measuring the position and speed of molecules in the box costs more energy than that derived from the resulting heat engine.

And heat engines can be useful things. Refrigerators provide a good analogy, Whitelam said. As the system runs, food inside stays cold the desired outcome even though the back of the fridge gets hot as a product of work done by the refrigerators motor.

In Whitelams simulations, the machine learning protocol can be thought of as the demon. In the process of optimization, it converts information drawn from the system modeled into energy as heat.

In one simulation, Whitelam optimized the process of dragging a nanoscale bead through water. He modeled a so-called optical trap in which laser beams, acting like tweezers of light, can hold and move a bead around.

The name of the game is: Go from here to there with as little work done on the system as possible, Whitelam said. The bead jiggles under natural fluctuations called Brownian motion as water molecules are bombarding it. Whitelam showed that if these fluctuations can be measured, moving the bead can then be done at the most energy efficient moment.

Here were showing that we can train a neural-network demon to do something similar to Maxwells thought experiment but with an optical trap, he said.

Whitelam extended the idea to microelectronics and computation. He used the machine learning protocol to simulate flipping the state of a nanomagnetic bit between 0 and 1, which is a basic information-erasure/information-copying operation in computing.

Do this again, and again. Eventually, your demon will learn how to flip the bit so as to absorb heat from the surroundings, he said. He comes back to the refrigerator analogy. You could make a computer that cools down as it runs, with the heat being sent somewhere else in your data center.

Whitelam said the simulations are like a testbed for understanding concepts and ideas. And here the idea is just showing that you can perform these protocols, either with little energy expense, or energy sucked in at the cost of going somewhere else, using measurements that could apply in a real-life experiment, he said.

This research was supported by the Department of Energys Office of Science.

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Founded in 1931 on the belief that the biggest scientific challenges are best addressed by teams, Lawrence Berkeley National Laboratory and its scientists have been recognized with 16 Nobel Prizes. Today, Berkeley Lab researchers develop sustainable energy and environmental solutions, create useful new materials, advance the frontiers of computing, and probe the mysteries of life, matter, and the universe. Scientists from around the world rely on the Labs facilities for their own discovery science. Berkeley Lab is a multiprogram national laboratory, managed by the University of California for the U.S. Department of Energys Office of Science.

DOEs Office of Science is the single largest supporter of basic research in the physical sciences in the United States, and is working to address some of the most pressing challenges of our time. For more information, please visit energy.gov/science.

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Harnessing Machine Learning to Make Complex Systems More ... - Lawrence Berkeley National Laboratory (.gov)