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Researcher profile

Zirui Zhou

Zirui Zhou contributes to research discovery and scholarly infrastructure.

ResearcherAffiliation not importedOpen to collaborate
Artificial IntelligenceMachine Learningcs.CYcond-mat.mtrl-scicond-mat.softcond-mat.stat-mechmath.CAmath.DSphysics.chem-ph

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Published work

7 published item(s)

preprint2026arXiv

Atomic Alignment in PbS Nanocrystal Superlattices with Compact Inorganic Ligands via Reversible Oriented Attachment of Nanocrystals

Nanocrystals (NCs) serve as versatile building blocks for the creation of functional materials, with NC self-assembly offering opportunities to enable novel material properties. Here, we demonstrate that PbS NCs functionalized with strongly negatively charged metal chalcogenide complex (MCC) ligands, such as $Sn_2S_6^{4-}$ and $AsS_4^{3-}$, can self-assemble into all-inorganic superlattices with both long-range superlattice translational and atomic-lattice orientational order. Structural characterizations reveal that the NCs adopt unexpected edge-to-edge alignment, and numerical simulation clarifies that orientational order is thermodynamically stabilized by many-body ion correlations originating from the dense electrolyte. Furthermore, we show that the superlattices of $Sn_2S_6^{4-}$-functionalized PbS NCs can be fully disassembled back into the colloidal state, which is highly unusual for orientationally attached superlattices with atomic-lattice alignment. The reversible oriented attachment of NCs, enabling their dynamic assembly and disassembly into effectively single-crystalline superstructures, offers a pathway toward designing reconfigurable materials with adaptive and controllable electronic and optoelectronic properties.

0 citations0 reviewsNo code linkedOpen access
preprint2026arXiv

Latent Heuristic Search: Continuous Optimization for Automated Algorithm Design

The integration of Large Language Models (LLMs) into evolutionary frameworks has established a new paradigm for automated heuristic discovery. Despite their promise, these methods typically search in the discrete space of program syntax, relying on stochastic sampling to navigate a highly non-convex optimization landscape. This work proposes a continuous heuristic discovery framework that shifts optimization to a learned latent manifold. We employ an encoder to map discrete programs into continuous embeddings and train a differentiable surrogate model to predict performance, enabling gradient-based search. To regularize the optimization trajectory, an invertible normalizing flow maps these embeddings to a structured Gaussian prior, where we perform gradient ascent. The resulting optimized latent vectors are projected through a learned mapper into soft prompts, which condition a frozen LLM to synthesize novel executable heuristics. We evaluate the proposed method on the Traveling Salesman Problem (TSP), the Capacitated Vehicle Routing Problem (CVRP), the Knapsack Problem (KSP), and Online Bin Packing (OBP). Empirical results demonstrate that continuous latent-space optimization achieves performance competitive with state-of-the-art discrete evolutionary baselines while offering a complementary methodological alternative for automated algorithm design. The implementation code is available at \url{https://github.com/cheikh025/LHS}.

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preprint2022arXiv

Achieving Model Fairness in Vertical Federated Learning

Vertical federated learning (VFL) has attracted greater and greater interest since it enables multiple parties possessing non-overlapping features to strengthen their machine learning models without disclosing their private data and model parameters. Similar to other machine learning algorithms, VFL faces demands and challenges of fairness, i.e., the learned model may be unfairly discriminatory over some groups with sensitive attributes. To tackle this problem, we propose a fair VFL framework in this work. First, we systematically formulate the problem of training fair models in VFL, where the learning task is modelled as a constrained optimization problem. To solve it in a federated and privacy-preserving manner, we consider the equivalent dual form of the problem and develop an asynchronous gradient coordinate-descent ascent algorithm, where some active data parties perform multiple parallelized local updates per communication round to effectively reduce the number of communication rounds. The messages that the server sends to passive parties are deliberately designed such that the information necessary for local updates is released without intruding on the privacy of data and sensitive attributes. We rigorously study the convergence of the algorithm when applied to general nonconvex-concave min-max problems. We prove that the algorithm finds a $δ$-stationary point of the dual objective in $\mathcal{O}(δ^{-4})$ communication rounds under mild conditions. Finally, the extensive experiments on three benchmark datasets demonstrate the superior performance of our method in training fair models.

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preprint2022arXiv

Knowledge-Injected Federated Learning

Federated learning is an emerging technique for training models from decentralized data sets. In many applications, data owners participating in the federated learning system hold not only the data but also a set of domain knowledge. Such knowledge includes human know-how and craftsmanship that can be extremely helpful to the federated learning task. In this work, we propose a federated learning framework that allows the injection of participants' domain knowledge, where the key idea is to refine the global model with knowledge locally. The scenario we consider is motivated by a real industry-level application, and we demonstrate the effectiveness of our approach to this application.

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preprint2022arXiv

Revealing Unfair Models by Mining Interpretable Evidence

The popularity of machine learning has increased the risk of unfair models getting deployed in high-stake applications, such as justice system, drug/vaccination design, and medical diagnosis. Although there are effective methods to train fair models from scratch, how to automatically reveal and explain the unfairness of a trained model remains a challenging task. Revealing unfairness of machine learning models in interpretable fashion is a critical step towards fair and trustworthy AI. In this paper, we systematically tackle the novel task of revealing unfair models by mining interpretable evidence (RUMIE). The key idea is to find solid evidence in the form of a group of data instances discriminated most by the model. To make the evidence interpretable, we also find a set of human-understandable key attributes and decision rules that characterize the discriminated data instances and distinguish them from the other non-discriminated data. As demonstrated by extensive experiments on many real-world data sets, our method finds highly interpretable and solid evidence to effectively reveal the unfairness of trained models. Moreover, it is much more scalable than all of the baseline methods.

0 citations0 reviewsNo code linkedOpen access
preprint2017arXiv

Partially Bounded Transformations have Trivial Centralizer

We prove that for infinite rank-one transformations satisfying a property called "partial boundedness," the only commuting transformations are powers of the original transformation. This shows that a large class of infinite measure-preserving rank-one transformations with bounded cuts have trivial centralizers. We also characterize when partially bounded transformations are isomorphic to their inverse.

0 citations0 reviewsNo code linkedOpen access