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Two Science papers catalog 8,872 atomically thin layers to guide the search for twisted quantum materials
Physicists mapped the electronic topology of 8,872 atomically thin materials and named over 1,600 twisting candidates in two Science papers. The lists are calculations that tell labs where to look, and testing them in twisted devices comes next.
The Scientist · Science desk

What happened
- An international collaboration has two back-to-back papers on twisted-layer materials due in Science on Sept. 24.
- The first paper analyzed 8,872 two-dimensional entries from two computational databases and found 4,073 with nontrivial topology or an obstructed atomic limit.
- The calculations come with a new Topological 2D Materials Database that separates experimentally reported structures from computational candidates.
Compiled by The ScientistSomething wrong?How this is made
Why it matters
- capability Because the symmetry rules were released as analysis programs, other groups can run the same topology test on new layers as they are reported and extend the map themselves.
- constraint The symmetry analysis covers nonmagnetic layers only, so twisted stacks built from magnetic 2D materials fall outside this catalog and still have to be screened another way.
- decision A lab can move layers someone has already made to the top of its twisting list before spending growth time on a structure that so far exists only in a calculation.
About 46% of the entries landed in the unusual bucket [14]. That figure counts two different kinds of electronic order together. One is topology proper, a pattern that cannot change without a fundamental alteration of the electronic structure. The familiar example is the quantum spin Hall insulator, which is insulating inside and carries current along its edges through protected channels [18]. The other is an obstructed atomic limit. In one class of it, symmetry forces the centers of electronic charge to sit away from the atoms, and cutting the crystal along particular boundaries can expose distinctive electronic states [6].
The first paper extends topological quantum chemistry, a theory that ties a crystal's chemistry and symmetries to the topology of its electronic states, to two-dimensional layers [3]. "The symmetry of a crystal gives us rules for how its electronic states can be arranged. We developed those rules for layers and turned them into tools that researchers can apply to thousands of materials," said Luis Elcoro of the Max Planck Institute for the Structure and Dynamics of Matter in Hamburg, senior author of one of the studies [12][17].
The design choice I like best is that the catalog keeps the layers with no topology. It records band structures, the energies available to electrons, for layers with and without topology [9]. For twisting, the starting electronic structure is the input that counts. The team's recent Nature study of M-point twisting showed that changing it opens different physics [10]. "The first catalog gives us the electronic building blocks. We can then ask which ones to combine and twist," said Urko Petralanda of the University of the Basque Country, a first author of one study [13][17].
The second paper is there because the number of combinations grows fast. Two identical layers make a homobilayer, two different layers make a heterobilayer, and the twist angle is one more free choice [16]. If every one of the 8,872 entries could pair with every other, there would be about 39.4 million distinct heterobilayers before anyone picks an angle [15]. That ceiling ignores whether the layers can be made or stacked at all. The second paper puts a finite list in front of that search: more than 1,600 candidates for twisting, with electronic starting points that the collaboration says could enable new kinds of quantum simulators [7].
The thing this doesn't tell you is whether any candidate will produce a new state in a device. In my view the catalog saves theorists the most time now. Its value to experimental groups depends on how many of the candidates can be made and twisted. The platforms that set the current bar got there by measurement: twisted graphene and transition metal dichalcogenides have yielded superconductivity and fractional Chern insulators [2].
"Every new family of twisted materials gives us a chance to ask a different question about quantum matter. We want to move beyond the few platforms we know and explore the enormous range of physics that other layers and other twists could make possible," said B. Andrei Bernevig, a Princeton physics professor and co-author of both studies [11][17].
What to watch
- A first stacked, twisted device built from one of the 1,600-plus candidates that shows a state predicted from its starting band structure.
- The number of database entries flagged as experimentally reported once the papers publish on Sept. 24, since it sets how much of the shortlist a lab can try soon.