An Investigation in the Kinetic Persistence of TiO$_2$ Polymorphs using Machine Learning Driven Pathfinding in Crystal Configuration Space

Kavli Affiliate: Kristin Persson | Summary:As the number of theoretically predicted materials continues to grow, it becomes increasingly important to assess not only their thermodynamic stability but also their kinetic viability under realistic synthesis conditions. In this study, we investigate the hypothesis that the kinetic persistence of a metastable polymorph is related to the topography […]


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Generative design of inorganic materials

Kavli Affiliate: Gerbrand Ceder| Summary:Materials discovery is fundamental to advance next-generation technologies as well as for sustainable and circular economy. Beyond computational screening, generative models are efficient at finding materials with desired properties, via multi-modal learning using multiscale data. This perspective examines the landscape of generative design for inorganic materials and discusses the integration of […]


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Generative design of inorganic materials

Kavli Affiliate: Gerbrand Ceder| Summary:Materials discovery is fundamental to advance next-generation technologies as well as for sustainable and circular economy. Beyond computational screening, generative models are efficient at finding materials with desired properties, via multi-modal learning using multiscale data. This perspective examines the landscape of generative design for inorganic materials and discusses the integration of […]


Continue.. Generative design of inorganic materials

Generative design of inorganic materials

Kavli Affiliate: Gerbrand Ceder| Summary:Materials discovery is fundamental to advance next-generation technologies as well as for sustainable and circular economy. Beyond computational screening, generative models are efficient at finding materials with desired properties, via multi-modal learning using multiscale data. This perspective examines the landscape of generative design for inorganic materials and discusses the integration of […]


Continue.. Generative design of inorganic materials

Agentic LLM Reasoning in a Self-Driving Laboratory for Air-Sensitive Lithium Halide Spinel Conductors

Kavli Affiliate: Gerbrand Ceder| Summary:Self-driving laboratories promise to accelerate materials discovery. Yet current automated solid-state synthesis platforms are limited to ambient conditions, thereby precluding their use for air-sensitive materials. Here, we present A-Lab for Glovebox Powder Solid-state Synthesis (A-Lab GPSS), a robotic platform capable of synthesizing and characterizing air-sensitive inorganic materials under strict air-free conditions. […]


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Strain continuously rotates the Néel vector in altermagnetic MnTe

Kavli Affiliate: James Analytis| Summary:Altermagnetism has recently emerged as a distinct class of collinear antiferromagnets that break time-reversal symmetry, exhibiting a host of novel properties. Applied strain has attracted particular attention as a key tuning parameter for altermagnets. Although several experimental studies have demonstrated the preparation of single-domain states through a combination of applied strain […]


Continue.. Strain continuously rotates the Néel vector in altermagnetic MnTe

Topochemically-engineered coexistence of charge and spin orders in intercalated endotaxial heterostructures

Kavli Affiliate: Kwabena Bediako| Summary:Correlated electron systems that host multiple electronic orders offer routes to multifunctional quantum materials, but strong competition between these orders often prevents their coexistence. Here we show that nanoscale, metastable intercalated heterostructures can stabilize a rare combination of long-range magnetism and a commensurate charge density wave (C-CDW) order in a single […]


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Faster Symmetric Rendezvous on Four or More Locations

Kavli Affiliate: Felix Fischer | Summary:In the symmetric rendezvous problem two players follow the same (randomized) strategy to visit one of $n$ locations in each time step $t=0,1,2,dots$. Their goal is to minimize the expected time until they visit the same location and thus meet. Anderson and Weber [J. Appl. Prob., 1990] proposed a strategy […]


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Faster Symmetric Rendezvous on Four or More Locations

Kavli Affiliate: Felix Fischer | Summary:In the symmetric rendezvous problem, two players follow the same (randomized) strategy to visit one of $n$ locations in each time step $t=0,1,2,dots$. Their goal is to minimize the expected time until they visit the same location and thus meet. A canonical strategy due to Anderson and Weber is known […]


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annbatch unlocks terabyte-scale training of biological data in anndata

Kavli Affiliate: Felix Fischer | Summary:The scale of biological datasets now routinely exceeds system memory, making data access rather than model computation the primary bottleneck in training machine-learning models. This bottleneck is particularly acute in biology, where widely used community data formats must support heterogeneous metadata, sparse and dense assays, and downstream analysis within established […]


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