arXiv subjects

Zhendong Li

Publications and source records attributed to Zhendong Li.

At least 73 records · Page 4Linked to original sources

arXiv2025

Quantum spin excitations in a dual-core magnetic molecule

Magnetic excitations are important quantum phenomena in magnetic systems and have been widely studied in individual magnetic atoms and molecules as well as their assembled structures over the past few decades. Using scanning tunneling microscopy/spectroscopy (STM/S) combined with density functional theory (DFT) and the state-of-the-art ab initio wavefunction calculations, we investigated the properties of a novel dual-core Cr2Br6 molecule, which consists of two Cr ions coupled via superexchange through a single near-90° Cr-Br-Cr scissors bond. Under zero magnetic field, we observed a Fano peak with multi-steps through STS. When an external magnetic field is applied, some steps exhibit additional splitting, while others change little. We find that the Cr2Br6, exhibits a spin-degenerate ground state, and the complex peak splitting arises from the coexistence of vibrational and magnetic excitations in the molecule. Our results reveal rich quantum spin behavior in a well-defined two-core magnetic trihalide complex at the atomic scale, offering not only a minimal model for superexchange-coupled multi-spin quantum excitations but also a possible foundational unit for future molecule-based quantum functionalities.

cond-mat.mtrl-sci↗

arXiv2025

Generalized many-body perturbation theory for the electron correlation energy: multi-reference random phase approximation via diagrammatic resummation

Many-body perturbation theory (MBPT) based on Green's functions and Feynman diagrams provides a fundamental theoretical framework for various \emph{ab initio} computational approaches in molecular and materials science, including the random phase approximation (RPA) and $GW$ approximation. Unfortunately, this perturbation expansion often fails in systems with strong multi-reference characters. Extending diagrammatic MBPT to the multi-reference case is highly nontrivial and remains largely unexplored, primarily due to the breakdown of Wick's theorem. In this work, we develop a diagrammatic multi-reference generalization of MBPT for computing correlation energies of strongly correlated systems, by using the cumulant expansion of many-body Green's function in place of Wick's theorem. This theoretical framework bridges the gap between MBPT in condensed matter physics and multi-reference perturbation theories (MRPT) in quantum chemistry, which had been almost exclusively formulated within time-independent wavefunction frameworks prior to this work. Our formulation enables the explicit incorporation of strong correlation effects from the outset as in MRPT, while treating residual weak interactions through a generalized diagrammatic perturbation expansion as in MBPT. As a concrete demonstration, we formulate a multi-reference (MR) extension of the standard single-reference (SR) RPA by systematically resumming generalized ring diagrams, which naturally leads to a unified set of equations applicable to both SR and MR cases. Benchmark calculations on prototypical molecular systems reveal that MR-RPA successfully resolves the well-known failure of SR-RPA in strongly correlated systems. This theoretical advancement paves the way for advancing \emph{ab initio} computational methods through diagrammatic resummation techniques in future.

quant-ph↗

arXiv2025

Multi-set variational quantum dynamics algorithm for simulating nonadiabatic dynamics on quantum computers

Accelerating quantum dynamical simulations with quantum computing has received considerable attention but remains a significant challenge. In variational quantum algorithms for quantum dynamics, designing an expressive and shallow-depth parameterized quantum circuit (PQC) is a key difficulty. Here, we proposed a multi-set variational quantum dynamics algorithm (MS-VQD) tailored for nonadiabatic dynamics involving multiple electronic states. MS-VQD employs multiple PQCs to represent the electronic-nuclear coupled wavefunction, with each circuit adapting to the motion of nuclear wavepacket on a specific potential energy surface. By simulating excitation energy transfer dynamics in molecular aggregates described by the Frenkel-Holstein model, we demonstrated that MS-VQD achieves the same accuracy as traditional VQD while requiring significantly shallower PQCs. Notably, its advantage increases with the number of electronic states, making it suitable for simulating nonadiabatic quantum dynamics in complex molecular systems.

physics.chem-ph↗

arXiv2025

Enhancing Robustness and Security in ISAC Network Design: Leveraging Transmissive Reconfigurable Intelligent Surface with RSMA

In this paper, we propose a novel transmissive reconfigurable intelligent surface transceiver-enhanced robust and secure integrated sensing and communication network. A time-division sensing communication mechanism is designed for the scenario, which enables communication and sensing to share wireless resources. To address the interference management problem and hinder eavesdropping, we implement rate-splitting multiple access (RSMA), where the common stream is designed as a useful signal and an artificial noise, while taking into account the imperfect channel state information and modeling the channel for the illegal users in a fine-grained manner as well as giving an upper bound on the error. We introduce the secrecy outage probability and construct an optimization problem with secrecy sum-rate as the objective functions to optimize the common stream beamforming matrix, the private stream beamforming matrix and the timeslot duration variable. Due to the coupling of the optimization variables and the infinity of the error set, the proposed problem is a nonconvex optimization problem that cannot be solved directly. In order to address the above challenges, the block coordinate descent-based second-order cone programming algorithm is used to decouple the optimization variables and solving the problem. Specifically, the problem is decoupled into two subproblems concerning the common stream beamforming matrix, the private stream beamforming matrix, and the timeslot duration variable, which are solved by alternating optimization until convergence is reached. To solve the problem, S-procedure, Bernstein's inequality and successive convex approximation are employed to deal with the objective function and non-convex constraints. Numerical simulation results verify the superiority of the proposed scheme in improving the secrecy energy efficiency and the Cramér-Rao boundary.

cs.IT↗

arXiv2024

UniLoc: Towards Universal Place Recognition Using Any Single Modality

To date, most place recognition methods focus on single-modality retrieval. While they perform well in specific environments, cross-modal methods offer greater flexibility by allowing seamless switching between map and query sources. It also promises to reduce computation requirements by having a unified model, and achieving greater sample efficiency by sharing parameters. In this work, we develop a universal solution to place recognition, UniLoc, that works with any single query modality (natural language, image, or point cloud). UniLoc leverages recent advances in large-scale contrastive learning, and learns by matching hierarchically at two levels: instance-level matching and scene-level matching. Specifically, we propose a novel Self-Attention based Pooling (SAP) module to evaluate the importance of instance descriptors when aggregated into a place-level descriptor. Experiments on the KITTI-360 dataset demonstrate the benefits of cross-modality for place recognition, achieving superior performance in cross-modal settings and competitive results also for uni-modal scenarios. Our project page is publicly available at https://yan-xia.github.io/projects/UniLoc/.

cs.CV↗

arXiv2024

Beamforming Design and Multi-User Scheduling in Transmissive RIS Enabled Distributed Cooperative ISAC Networks with RSMA

In this paper, we propose a novel transmissive reconfigurable intelligent surface (TRIS) transceiver-empowered distributed cooperative integrated sensing and communication (ISAC) network to enhance coverage as well as to enhance wireless environment understanding. Based on the network requirements, the users are categorized into cooperative users (CUEs) and destination users (DUEs), and the CUEs utilize their own resources to serve the DUEs. To realize cooperation, we implement rate-splitting multiple access (RSMA) at the base station (BS), where the common stream is decoded and reencoded at the CUEs and forwarded to the DUEs, while the private stream satisfies the CUEs' own communication requirements. We construct an optimization problem with maximum minimum radar mutual information (RMI) as the objective function to optimize the BS beamforming matrix, the CUE beamforming matrices, the common stream rate vectors, and the user scheduling vectors. Due to the coupling of the optimization variables and non-convex operation, the proposed problem is a non-convex optimization problem that cannot be solved directly. To address the above challenges, we adopt a consensus alternating direction method of multipliers (ADMM) framework to decouple the optimization variables and solve it. Specifically, the problem is decoupled into multiple subproblems and solved by iterative optimization independently until overall convergence is achieved. Finally, numerical results validate the superiority of the proposed scheme in terms of improving communication sum-rate and RMI, and greatly reduce the algorithm complexity.

cs.IT↗

arXiv2024

Model Predictive Control Enabled UAV Trajectory Optimization and Secure Resource Allocation

In this paper, we investigate a secure communication architecture based on unmanned aerial vehicle (UAV), which enhances the security performance of the communication system through UAV trajectory optimization. We formulate a control problem of minimizing the UAV flight path and power consumption while maximizing secure communication rate over infinite horizon by jointly optimizing UAV trajectory, transmit beamforming vector, and artificial noise (AN) vector. Given the non-uniqueness of optimization objective and significant coupling of the optimization variables, the problem is a non-convex optimization problem which is difficult to solve directly. To address this complex issue, an alternating-iteration technique is employed to decouple the optimization variables. Specifically, the problem is divided into three subproblems, i.e., UAV trajectory, transmit beamforming vector, and AN vector, which are solved alternately. Additionally, considering the susceptibility of UAV trajectory to disturbances, the model predictive control (MPC) approach is applied to obtain UAV trajectory and enhance the system robustness. Numerical results demonstrate the superiority of the proposed optimization algorithm in maintaining accurate UAV trajectory and high secure communication rate compared with other benchmark schemes.

eess.SP↗

arXiv2024

Towards TMA-Based Transmissive RIS Transceiver Enabled Downlink Communication Networks: A Consensus-ADMM Approach

This paper presents a novel multi-stream downlink communication system that utilizes a transmissive reconfigurable intelligent surface (RIS) transceiver. Specifically, we elaborate the downlink communication scheme using time-modulated array (TMA) technology, which enables high order modulation and multi-stream beamforming. Then, an optimization problem is formulated to maximize the minimum signal-to-interference-plusnoise ratio (SINR) with user fairness, which takes into account the constraint of the maximum available power for each transmissive element. Due to the non-convex nature of the formulated problem,finding optimal solution is challenging. To mitigate the complexity,we propose a linear-complexity beamforming algorithm based on consensus alternating direction method of multipliers (ADMM).Specifically, by introducing a set of auxiliary variables, the problem can be decomposed into multiple sub-problems that are amenable to parallel computation, where the each sub-problem can yield closed-form expressions, bringing a significant reduction in the computational complexity. The overall problem achieves convergence by iteratively addressing these sub-problems in an alternating manner. Finally, the convergence of the proposed algorithm and the impact of various parameter configurations on the system performance are validated through numerical simulations.

eess.SP↗

arXiv2024

Transmissive RIS Enabled Transceiver Systems:Architecture, Design Issues and Opportunities

Reconfigurable intelligent surface (RIS) is anticipated to augment the performance of beyond fifth-generation (B5G) and sixth-generation (6G) networks by intelligently manipulating the state of its components. Rather than employing reflective RIS for aided communications, this paper proposes an innovative transmissive RIS-enabled transceiver (TRTC) architecture that can accomplish the functions of traditional multi-antenna systems in a cost-effective and energy-efficient manner. First, the proposed network architecture and its corresponding transmission scheme are elaborated from the perspectives of downlink (DL) and uplink (UL) transmissions. Then, we illustrate several significant advantages and differences of TRTC compared to other multiantenna systems. Furthermore, the downlink modulation and extraction principle based on time-modulation array (TMA) is introduced in detail to tackle the multi-stream communications. Moreover, a near-far field channel model appropriate for this architecture is proposed. Based on the channel model, we summarize some state-of-the-art channel estimation schemes, and the channel estimation scheme of TRTC is also provided. Considering the optimization for DL and UL communications, we present numerical simulations that confirm the superiority of the proposed optimization algorithm. Lastly, numerous prospective research avenues for TRTC systems are delineated to inspire further exploration.

eess.SP↗

arXiv2024

Blockchain-Envisioned UAV-Aided Disaster Relief Networks: Challenges and Solutions

Natural or man-made disasters pose significant challenges for delivering critical relief to affected populations due to disruptions in critical infrastructures and logistics networks. Unmanned aerial vehicles (UAVs)-aided disaster relief networks (UDRNs) leverage UAVs to assist existing ground relief networks by swiftly assessing affected areas and timely delivering lifesaving supplies. To meet the growing demands for collaborative, trust-free, and transparent UDRN services, blockchain-based UDRNs emerge as a promising approach through immutable ledgers and distributed smart contracts. However, several efficiency and security challenges hinder the deployment of blockchain-based UDRNs, including the lack of cooperation between smart contracts, lack of dynamic audit for smart contract vulnerabilities, and low forensics robustness against transaction malleability attacks. Towards efficient and secure blockchain-based UDRNs, this paper presents potential solutions: (i) a series of collaborative smart contracts for coordinated relief management, (ii) a dynamic contract audit mechanism to prevent known/unknown contract vulnerabilities; and (iii) a robust transaction forensics strategy with on/off-chain cooperation to resist transaction malleability attacks. Our prototype implementation and experimental results demonstrate the feasibility and effectiveness of our approach. Lastly, we outline key open research issues crucial to advancing this emerging field.

cs.CR↗

arXiv2024

Cramer-Rao Bound Minimization for Movable Antenna-Assisted Multiuser Integrated Sensing and Communications

This paper investigates a movable antenna (MA)-assisted multiuser integrated sensing and communication (ISAC) system, where the base station (BS) and communication users are all equipped with MA for improving both the sensing and communication performance. We employ the Cramer-Rao bound (CRB) as the performance metric of sensing, thus a joint beamforming design and MAs' position optimizing problem is formulated to minimize the CRB. However the resulting optimization problem is NP-hard and the variables are highly coupled. To tackle this problem, we propose an alternating optimization (AO) framework by adopting semidefinite relaxation (SDR) and successive convex approximation (SCA) technique. Numerical results reveal that the proposed MA-assisted ISAC system achieves lower estimation CRB compared to the fixed-position antenna (FPA) counterpart.

eess.SP↗

arXiv2024

MindSpore Quantum: A User-Friendly, High-Performance, and AI-Compatible Quantum Computing Framework

We introduce MindSpore Quantum, a pioneering hybrid quantum-classical framework with a primary focus on the design and implementation of noisy intermediate-scale quantum (NISQ) algorithms. Leveraging the robust support of MindSpore, an advanced open-source deep learning training/inference framework, MindSpore Quantum exhibits exceptional efficiency in the design and training of variational quantum algorithms on both CPU and GPU platforms, delivering remarkable performance. Furthermore, this framework places a strong emphasis on enhancing the operational efficiency of quantum algorithms when executed on real quantum hardware. This encompasses the development of algorithms for quantum circuit compilation and qubit mapping, crucial components for achieving optimal performance on quantum processors. In addition to the core framework, we introduce QuPack, a meticulously crafted quantum computing acceleration engine. QuPack significantly accelerates the simulation speed of MindSpore Quantum, particularly in variational quantum eigensolver (VQE), quantum approximate optimization algorithm (QAOA), and tensor network simulations, providing astonishing speed. This combination of cutting-edge technologies empowers researchers and practitioners to explore the frontiers of quantum computing with unprecedented efficiency and performance.

quant-ph↗

arXiv2024

Quantum computation of conical intersections on a programmable superconducting quantum processor

Conical intersections (CIs) are pivotal in many photochemical processes. Traditional quantum chemistry methods, such as the state-average multi-configurational methods, face computational hurdles in solving the electronic Schrödinger equation within the active space on classical computers. While quantum computing offers a potential solution, its feasibility in studying CIs, particularly on real quantum hardware, remains largely unexplored. Here, we present the first successful realization of a hybrid quantum-classical state-average complete active space self-consistent field method based on the variational quantum eigensolver (VQE-SA-CASSCF) on a superconducting quantum processor. This approach is applied to investigate CIs in two prototypical systems - ethylene (C2H4) and triatomic hydrogen (H3). We illustrate that VQE-SA-CASSCF, coupled with ongoing hardware and algorithmic enhancements, can lead to a correct description of CIs on existing quantum devices. These results lay the groundwork for exploring the potential of quantum computing to study CIs in more complex systems in the future.

quant-ph↗

arXiv2024

Multiple Intelligent Reflecting Surfaces Collaborative Wireless Localization System

This paper studies a multiple intelligent reflecting surfaces (IRSs) collaborative localization system where multiple semi-passive IRSs are deployed in the network to locate one or more targets based on time-of-arrival. It is assumed that each semi-passive IRS is equipped with reflective elements and sensors, which are used to establish the line-of-sight links from the base station (BS) to multiple targets and process echo signals, respectively. Based on the above model, we derive the Fisher information matrix of the echo signal with respect to the time delay. By employing the chain rule and exploiting the geometric relationship between time delay and position, the Cramer-Rao bound (CRB) for estimating the target's Cartesian coordinate position is derived. Then, we propose a two-stage algorithmic framework to minimize CRB in single- and multi-target localization systems by joint optimizing active beamforming at BS, passive beamforming at multiple IRSs and IRS selection. For the single-target case, we derive the optimal closed-form solution for multiple IRSs coefficients design and propose a lowcomplexity algorithm based on alternating direction method of multipliers to obtain the optimal solution for active beaming design. For the multi-target case, alternating optimization is used to transform the original problem into two subproblems where semi-definite relaxation and successive convex approximation are applied to tackle the quadraticity and indefiniteness in the CRB expression, respectively. Finally, numerical simulation results validate the effectiveness of the proposed algorithm for multiple IRSs collaborative localization system compared to other benchmark schemes as well as the significant performance gains.

cs.IT↗

arXiv2024

Combating Advanced Persistent Threats: Challenges and Solutions

The rise of advanced persistent threats (APTs) has marked a significant cybersecurity challenge, characterized by sophisticated orchestration, stealthy execution, extended persistence, and targeting valuable assets across diverse sectors. Provenance graph-based kernel-level auditing has emerged as a promising approach to enhance visibility and traceability within intricate network environments. However, it still faces challenges including reconstructing complex lateral attack chains, detecting dynamic evasion behaviors, and defending smart adversarial subgraphs. To bridge the research gap, this paper proposes an efficient and robust APT defense scheme leveraging provenance graphs, including a network-level distributed audit model for cost-effective lateral attack reconstruction, a trust-oriented APT evasion behavior detection strategy, and a hidden Markov model based adversarial subgraph defense approach. Through prototype implementation and extensive experiments, we validate the effectiveness of our system. Lastly, crucial open research directions are outlined in this emerging field.

cs.CR↗

arXiv2024

Rate-Splitting Multiple Access for Transmissive Reconfigurable Intelligent Surface Transceiver Empowered ISAC System

In this paper, a novel transmissive reconfigurable intelligent surface (TRIS) transceiver empowered integrated sensing and communications (ISAC) system is proposed for future multi-demand terminals. To address interference management, we implement rate-splitting multiple access (RSMA), where the common stream is independently designed for the sensing service. We introduce the sensing quality of service (QoS) criteria based on this structure and construct an optimization problem with the sensing QoS criteria as the objective function to optimize the sensing stream precoding matrix and the communication stream precoding matrix. Due to the coupling of optimization variables, the formulated problem is a non-convex optimization problem that cannot be solved directly. To tackle the above-mentioned challenging problem, alternating optimization (AO) is utilized to decouple the optimization variables. Specifically, the problem is decoupled into three subproblems about the sensing stream precoding matrix, the communication stream precoding matrix, and the auxiliary variables, which is solved alternatively through AO until the convergence is reached. For solving the problem, successive convex approximation (SCA) is applied to deal with the sum-rate threshold constraints on communications, and difference-of-convex (DC) programming is utilized to solve rank-one non-convex constraints. Numerical simulation results verify the superiority of the proposed scheme in terms of improving the communication and sensing QoS.

cs.IT↗

arXiv2024

Antenna Positioning and Beamforming Design for Fluid-Antenna Enabled Multi-user Downlink Communications

This paper investigates a multiple input single output (MISO) downlink communication system in which users are equipped with fluid antennas (FAs). First, we adopt a field-response based channel model to characterize the downlink channel with respect to FAs' positions. Then, we aim to minimize the total transmit power by jointly optimizing the FAs' positions and beamforming matrix. To solve the resulting non-convex problem, we employ an alternating optimization (AO) algorithm based on penalty method and successive convex approximation (SCA) to obtain a sub-optimal solution. Numerical results demonstrate that the FA-assisted communication system performs better than conventional fixed position antennas system.

cs.IT↗

arXiv2023

Physics-Constrained Hardware-Efficient Ansatz on Quantum Computers that is Universal, Systematically Improvable, and Size-consistent

Variational wavefunction ansätze are at the heart of solving quantum many-body problems in physics and chemistry. Previous designs of hardware-efficient ansatz (HEA) on quantum computers are largely based on heuristics and lack rigorous theoretical foundations. In this work, we introduce a physics-constrained approach for designing HEA with rigorous theoretical guarantees by imposing a few fundamental constraints. Specifically, we require that the target HEA to be universal, systematically improvable, and size-consistent, which is an important concept in quantum many-body theories for scalability, but has been overlooked in previous designs of HEA. We extend the notion of size-consistency to HEA, and present a concrete realization of HEA that satisfies all these fundamental constraints while only requiring linear qubit connectivity. The developed physics-constrained HEA is superior to other heuristically designed HEA in terms of both accuracy and scalability, as demonstrated numerically for the Heisenberg model and some typical molecules. In particular, we find that restoring size-consistency can significantly reduce the number of layers needed to reach certain accuracy. In contrast, the failure of other HEA to satisfy these constraints severely limits their scalability to larger systems with more than ten qubits. Our work highlights the importance of incorporating physical constraints into the design of HEA for efficiently solving many-body problems on quantum computers.

quant-ph↗