output
20162026
most citedA Symmetry-orientated Divide-and-Conquer Method for Crystal Structure Prediction

140 citations

39 papers

cs.CV2026

Row-Column Separated Attention Based Low-Light Image/Video Enhancement

Chengqi Dong, Zhiyuan Cao, Tuoshi Qi +3

U-Net structure is widely used for low-light image/video enhancement. The enhanced images result in areas with large local noise and loss of more details without proper guidance fo…

cond-mat.mtrl-sci2026

Unlocking the Power of Orbital-Free Density Functional Theory to Explore the Electronic Structure Under Extreme Conditions

Cheng Ma, Qiang Xu, Zhenhao Zhang +8

Recent advances in X-ray free-electron laser diagnostics have enabled direct probing of the electronic structure under extreme pressures and temperatures, such as those encountered…

physics.plasm-ph2025★ 3 cited

Ab initio density functional theory approach to warm dense hydrogen: from density response to electronic correlations

Zhandos A. Moldabekov, Xuecheng Shao, Hannah M. Bellenbaum +5

Understanding the properties of warm dense hydrogen is of key importance for the modeling of compact astrophysical objects and to understand and further optimize inertial confineme…

cond-mat.mtrl-sci2025★ 3 cited

Zeeman-type spin splittings in strained d-wave altermagnets

Yahui Zhai, Longju Yu, Jian Lv +2

Recently, altermagnetic materials have become rather attractive because such materials showcase combined advantages of ferromagnets (e.g., spin current) and antiferromagnets (e.g.,…

cs.SE2025★ 2 cited

Optimizing Case-Based Reasoning System for Functional Test Script Generation with Large Language Models

Siyuan Guo, Huiwu Liu, Xiaolong Chen +6

In this work, we explore the potential of large language models (LLMs) for generating functional test scripts, which necessitates understanding the dynamically evolving code struct…

cond-mat.supr-con2025★ 6 cited

The Impact of Ionic Anharmonicity on Superconductivity in Metal-Stuffed B-C Clathrates

Wenbo Zhao, Ying Sun, Jiaxiang Li +8

Metal-stuffed BC compounds with sodalite clathrate structure have captured increasing attention due to their predicted exceptional superconductivity above liquid nitrogen temper…

cond-mat.mtrl-sci2024★ 14 cited

CrystalFlow: A Flow-Based Generative Model for Crystalline Materials

Xiaoshan Luo, Zhenyu Wang, Qingchang Wang +4

Deep learning-based generative models have emerged as powerful tools for modeling complex data distributions and generating high-fidelity samples, offering a transformative approac…

astro-ph.CO2024★ 4 cited

Global signal in the redshifted hydrogen 21-cm line from the Dark Ages and Cosmic Dawn: Dependence on the nature of dark matter and modeling of first light

Bohdan Novosyadlyj, Yurii Kulinich, Danylo Koval

We estimate the global signal in the redshifted hyperfine structure line 21 cm of hydrogen atoms formed during the Dark Ages and Cosmic Dawn epochs. The evolution of the brightness…

astro-ph.CO2024★ 1 cited

Impact of the cosmological expansion on spectral energy density of radiation in the intergalactic medium and once more about Olbers' paradox

Anguohao Yang, Bohdan Novosyadlyj, Gennadi Milinevsky

We analyse the impact of the expansion of the Universe on the formation of the total spectral energy density of radiation in the intergalactic medium. Assuming the same proper ther…

physics.comp-ph2024★ 5 cited

Nonlocal free-energy density functional for warm dense matter

Cheng Ma, Min Chen, Yu Xie +4

Finite-temperature orbital-free density functional theory (FT-OFDFT) holds significant promise for simulating warm dense matter due to its favorable scaling with both system size a…

astro-ph.CO2024★ 3 cited

On the Possibility of Detecting a Global Signal in the Line of the Hyperfine Structure of Hydrogen from the Dark Ages

Olexandr Konovalenko, Vyacheslav Zakharenko, Bohdan Novosyadlyj +7

We analyze the possibilities of detecting a signal in the hydrogen 21~cm line, which was formed in the early Universe during the the Dark Ages cosmological epoch, using the Ukraini…

physics.comp-ph2023★ 24 cited

Theoretical evidence of H-He demixing under Jupiter and Saturn conditions

Xiaoju Chang, Bo Chen, Qiyu Zeng +12

The immiscibility of hydrogen-helium mixture under the temperature and pressure conditions of planetary interiors is crucial for understanding the structures of gas giant planets (…

cond-mat.mtrl-sci2023★ 13 cited

Engineering ferroelectricity in monoclinic hafnia

Hong Jian Zhao, Yuhao Fu, Longju Yu +4

Ferroelectricity in the complementary metal-oxide semiconductor (CMOS)-compatible hafnia (HfO) is crucial for the fabrication of high-integration nonvolatile memory devices. Ho…

cs.LG2023★ 2 cited

A Simple Unified Uncertainty-Guided Framework for Offline-to-Online Reinforcement Learning

Siyuan Guo, Yanchao Sun, Jifeng Hu +5

Offline reinforcement learning (RL) provides a promising solution to learning an agent fully relying on a data-driven paradigm. However, constrained by the limited quality of the o…

cond-mat.mtrl-sci2023★ 9 cited

The anti-symmetric and anisotropic symmetric exchange interactions between electric dipoles in hafnia

Longju Yu, Hong Jian Zhao, Peng Chen +2

The anti-symmetric and anisotropic symmetric exchange interactions between two magnetic dipole moments - responsible for intriguing magnetic textures (e.g., magnetic skyrmions) - h…

cond-mat.supr-con2023★ 41 cited

Observation of non-superconducting phase changes in LuHN

Xiangzhuo Xing, Chao Wang, Linchao Yu +13

The recent report of near-ambient superconductivity in nitrogen doped lutetium hydride has triggered a worldwide fanaticism and raised major questions about the latest claims. An i…

cond-mat.supr-con2022★ 55 cited

Synthesis and Superconductivity in yttrium superhydrides under high pressure

Yingying Wang, Kui Wang, Yao Sun +6

The flourishing rare earth superhydrides are a class of recently discovered materials that possess near-room-temperature superconductivity at high pressures, opening a new era of s…

cond-mat.supr-con2022★ 130 cited

Efficient route to achieve superconductivity improvement via substitutional La-Ce alloy superhydride at high pressure

Jingkai Bi, Yuki Nakamoto, Katsuya Shimizu +4

The discovery of clathrate superhydrides has approached the long-standing dream of room-temperature superconductivity and thus inspired their prosperous research under high pressur…

cond-mat.mtrl-sci2022★ 34 cited

Zeeman effect in centrosymmetric antiferromagnets controlled by an electric field

Hong Jian Zhao, Xinran Liu, Yanchao Wang +3

Centrosymmetric antiferromagnetic semiconductors, although abundant in nature, seem less promising than ferromagnets and ferroelectrics for practical applications in semiconductor…

gr-qc2022★ 1 cited

Effect of medium on fundamental interactions in gravity and condensed matter

Alexander Zhuk, Valerii Shulga

Recently, it was shown that the gravitational field undergoes exponential cutoff at large cosmological scales due to the presence of background matter. In this article, we demonstr…

cond-mat.mtrl-sci2022★ 39 cited

Nonlocal Pseudopotential Energy Density Functional for Orbital-Free Density Functional Theory

Qiang Xu, Cheng Ma, Wenhui Mi +2

Orbital-free density functional theory (OF-DFT) runs at low computational cost that scales linearly with the number of simulated atoms, making it suitable for large-scale material…

cond-mat.mtrl-sci2021★ 33 cited

Design and Synthesis of Clathrate LaB8 with Superconductivity

Liang Ma, Xin Yang, Guangtao Liu +6

Boron-based clathrate materials, typically with three-dimensional networks of B atoms, have tunable properties through substitution of guest atoms, but the tuning of B cages themse…

cond-mat.mtrl-sci2021★ 140 cited

A Symmetry-orientated Divide-and-Conquer Method for Crystal Structure Prediction

Xuecheng Shao, Jian Lv, Peng Liu +5

Crystal structure prediction has been a subject of topical interest, but remains a substantial challenge, especially for complex structures as it deals with the global minimization…

cond-mat.mtrl-sci2021★ 51 cited

En route to high Tc superconductivity via Rb substitution of guest metal atoms in SrB3C3 clathrate

Peiyu Zhang, Xue Li, Xin Yang +3

Recently, a host/guest clathrate SrB3C3 with sp3-bonded boron-carbon framework was synthesized at around 50 GPa. On the basis of electron count, the structure is understood as gues…