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The functionality of ferroelectrics is often constrained by their Curie temperature, above which depolarization occurs. Lithium (Li) is the only experimentally known substitute that can increase the Curie temperature in ferroelectric niobate-based perovskites, yet the mechanism remains unresolved. Here, the unique phenomenon in Li-substituted KNbO3 is investigated using first-principles density functional theory. Theoretical calculations show that Li substitution at the A-site of perovskite introduces compressive chemical pressure, reducing Nb-O hybridization and associated ferroelectric instability. However, the large off-center displacement of the Li cation compensates for this reduction and further enhances the soft polar mode, thereby raising the Curie temperature. In addition, the stability of the tetragonal phase over the orthorhombic phase is predicted upon Li substitution, which reasonably explains the experimental observation of a decreased orthorhombic-to-tetragonal phase transition temperature. Finally, a metastable anti-phase polar state in which the Li cation displaces oppositely to the Nb cation is revealed, which could also contribute to the variation of phase transition temperatures. These findings provide critical insights into the atomic-scale mechanisms governing Curie temperature enhancement in ferroelectrics and pave the way for designing advanced ferroelectric materials with improved thermal stability and functional performance.

Graph unlearning, which aims to eliminate the influence of specific nodes, edges, or attributes from a trained Graph Neural Network (GNN), is essential in applications where privacy, bias, or data obsolescence is a concern. However, existing graph unlearning techniques often necessitate additional training on the remaining data, leading to significant computational costs, particularly with large-scale graphs. To address these challenges, we propose a two-stage training-free approach, Erase then Rectify (ETR), designed for efficient and scalable graph unlearning while preserving the model utility. Specifically, we first build a theoretical foundation showing that masking parameters critical for unlearned samples enables effective unlearning. Building on this insight, the Erase stage strategically edits model parameters to eliminate the impact of unlearned samples and their propagated influence on intercorrelated nodes. To further ensure the GNN's utility, the Rectify stage devises a gradient approximation method to estimate the model's gradient on the remaining dataset, which is then used to enhance model performance. Overall, ETR achieves graph unlearning without additional training or full training data access, significantly reducing computational overhead and preserving data privacy. Extensive experiments on seven public datasets demonstrate the consistent superiority of ETR in model utility, unlearning efficiency, and unlearning effectiveness, establishing it as a promising solution for real-world graph unlearning challenges., Comment: Under review

Graph Neural Networks (GNNs) have demonstrated remarkable proficiency in handling a range of graph analytical tasks across various domains, such as e-commerce and social networks. Despite their versatility, GNNs face significant challenges in transferability, limiting their utility in real-world applications. Existing research in GNN transfer learning overlooks discrepancies in distribution among various graph datasets, facing challenges when transferring across different distributions. How to effectively adopt a well-trained GNN to new graphs with varying feature and structural distributions remains an under-explored problem. Taking inspiration from the success of Low-Rank Adaptation (LoRA) in adapting large language models to various domains, we propose GraphLoRA, an effective and parameter-efficient method for transferring well-trained GNNs to diverse graph domains. Specifically, we first propose a Structure-aware Maximum Mean Discrepancy (SMMD) to align divergent node feature distributions across source and target graphs. Moreover, we introduce low-rank adaptation by injecting a small trainable GNN alongside the pre-trained one, effectively bridging structural distribution gaps while mitigating the catastrophic forgetting. Additionally, a structure-aware regularization objective is proposed to enhance the adaptability of the pre-trained GNN to target graph with scarce supervision labels. Extensive experiments on six real-world datasets demonstrate the effectiveness of GraphLoRA against eleven baselines by tuning only 20% of parameters, even across disparate graph domains. The code is available at https://anonymous.4open.science/r/GraphLoRA., Comment: Under review

GRB 230812B, detected by the Gamma-Ray Integrated Detectors (GRID) constellation mission, is an exceptionally bright gamma-ray burst (GRB) with a duration of only 3 seconds. Sitting near the traditional boundary ($\sim$ 2 s) between long and short GRBs, GRB 230812B is notably associated with a supernova (SN), indicating a massive star progenitor. This makes it a rare example of a short-duration GRB resulting from stellar collapse. Our analysis, using a time-evolving synchrotron model, suggests that the burst has an emission radius of approximately $10^{14.5}$~cm. We propose that the short duration of GRB 230812B is due to the combined effects of the central engine's activity time and the time required for the jet to break through the stellar envelope. Our findings provide another case that challenges the conventional view that short-duration GRBs originate exclusively from compact object mergers, demonstrating that a broader range of durations exists for GRBs arising from the collapse of massive stars., Comment: 10 pages, 3 tables, 11 figures

Topological phases associated with non-Abelian charges can exhibit a distinguished bulk-edge correspondence compared with Abelian phases, although elucidating this relationship remains challenging in traditional solid-state systems. In this paper, we propose a theoretical framework for synthesizing non-Abelian quaternion charges in ultracold atomic gases. By designing artificial spin-orbit coupling patterns, the topological edge modes demonstrate a clear correspondence with the band topology determined by various quaternion charges. This paves the way for observing the interface modes whose existence is attributed to the nonconservation multiplication relation, which is fundamental to non-Abelian charges. This scheme can be readily implemented using current ultracold atom techniques, offering a promising approach to explore the intriguing non-Abelian characteristics of the system., Comment: 10 pages, 8 figures

Next-basket recommendation (NBR) aims to infer the items in the next basket given the corresponding basket sequence. Existing NBR methods are mainly based on either message passing in a plain graph or transition modelling in a basket sequence. However, these methods only consider point-to-point binary item relations while item dependencies in real world scenarios are often in higher order. Additionally, the importance of the same item to different users varies due to variation of user preferences, and the relations between items usually involve various aspects. As pretrained language models (PLMs) excel in multiple tasks in natural language processing (NLP) and computer vision (CV), many researchers have made great efforts in utilizing PLMs to boost recommendation. However, existing PLM-based recommendation methods degrade when encountering Out-Of-Vocabulary (OOV) items. OOV items are those whose IDs are out of PLM's vocabulary and thus unintelligible to PLM. To settle the above challenges, we propose a novel method HEKP4NBR, which transforms the knowledge graph (KG) into prompts, namely Knowledge Tree Prompt (KTP), to help PLM encode the OOV item IDs in the user's basket sequence. A hypergraph convolutional module is designed to build a hypergraph based on item similarities measured by an MoE model from multiple aspects and then employ convolution on the hypergraph to model correlations among multiple items. Extensive experiments are conducted on HEKP4NBR on two datasets based on real company data and validate its effectiveness against multiple state-of-the-art methods.

An intriguing phenomenon in molecular collisions is the occurrence of scattering resonances, which originate from bound and quasi-bound states supported by the interaction potential at low collision energies. The resonance effects in the scattering behaviour are extraordinarily sensitive to the interaction potential, and their observation provides one of the most stringent tests for theoretical models. We present high-resolution measurements of state-resolved angular scattering distributions for inelastic collisions between Zeeman-decelerated C($^3P_1$) atoms and $\textit{para}$-H$_2$ molecules at collision energies ranging from 77 cm$^{-1}$ down to 0.5 cm$^{-1}$. Rapid variations in the angular distributions were observed that can be attributed to the consecutive reduction of contributing partial waves and effects of scattering resonances. The measurements showed excellent agreement with distributions predicted by $\textit{ab initio}$ quantum scattering calculations. However, discrepancies were found at specific collision energies, which most likely originate from an incorrectly predicted quasi-bound state. These observations provide exciting prospects for further high-precision and low-energy investigations of scattering processes that involve paramagnetic species.