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Mohammad Hassan

Publications and source records attributed to Mohammad Hassan.

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Modifying van der Waals Materials via Cavity Vacuum Fluctuations

In the field of cavity quantum materials, vacuum fluctuations of optical cavities are used for modifying ground-state properties of quantum materials without external driving. Here, one example is the van der Waals (vdW)/dispersion interaction in layered 2D vdW materials, where non-additive long-range correlations can dominate the interlayer binding. While cavity-induced changes of such interactions have been predicted and described using ab initio methods for molecular systems, no efficient description exists yet for extended materials. In this Letter, we close this gap by introducing a periodic formulation of the photon many-body dispersion (pMBD) functional within quantum electrodynamical density-functional theory (QEDFT). Applying this method with efficient $\textbf{q}$-point sampling to bilayer hBN and graphene, we predict cavity-modified stacking, increased equilibrium interlayer distances, and softened layer breathing modes with increasing light-matter coupling strength. Our results establish cavity vacuum fluctuations as a tuning knob for the structural properties of vdW materials.

cond-mat.mtrl-sci

Exploring Student Perception on Gen AI Adoption in Higher Education: A Descriptive Study

The rapid proliferation of Generative Artificial Intelligence (GenAI) is reshaping pedagogical practices and assessment models in higher education. While institutional and educator perspectives on GenAI integration are increasingly documented, the student perspective remains comparatively underexplored. This study examines how students perceive, use, and evaluate GenAI within their academic practices, focusing on usage patterns, perceived benefits, and expectations for institutional support. Data were collected through a questionnaire administered to 436 postgraduate Computer Science students at the University of Hertfordshire and analysed using descriptive methods. The findings reveal a Confidence-Competence Paradox: although more than 60% of students report high familiarity with tools such as ChatGPT, daily academic use remains limited and confidence in effective application is only moderate. Students primarily employ GenAI for cognitive scaffolding tasks, including concept clarification and brainstorming, rather than fully automated content generation. At the same time, respondents express concerns regarding data privacy, reliability of AI-generated information, and the potential erosion of critical thinking skills. The results also indicate strong student support for integrating AI literacy into curricula and programme Knowledge, Skills, and Behaviours (KSBs). Overall, the study suggests that universities should move beyond a policing approach to GenAI and adopt a pedagogical framework that emphasises AI literacy, ethical guidance, and equitable access to AI tools.

cs.CY

Super-Poissonian Squeezed Light in the Ground State of Strongly Coupled Light-matter Systems

Strong light-matter coupling enables hybrid states in which photonic and electronic degrees of freedom become correlated even in the ground state. While many-body effects in long-range dispersion interactions are known to reshape electronic properties under such conditions, their impact on quantum-optical observables remains largely unexplored. Here, we address this problem using quantum electrodynamical density-functional theory (QEDFT) combined with the recently developed photon-many-body dispersion (pMBD) functional, which can capture higher-order electron-photon correlations and multi-photon processes. We compute ground-state photonic observables including photon number fluctuations, second-order correlations, and quadrature variances, and find squeezing and super-Poissonian photon statistics emerging from light-matter interactions in the strong coupling regime. Our results demonstrate that capturing the full hierarchy of many-body, electron-photon and multi-photon correlations is essential for a consistent description of quantum-optical properties in strongly coupled molecular systems, establishing QEDFT as a first-principles framework for predicting nonclassical photonic features in the ground state of complex systems.

physics.chem-ph

Aggregate Modeling of Air-Conditioner Loads Under Packet-based Control with Both On and Off Grid Access Requests

Coordination of distributed energy resources (DERs) can engender flexibility necessary to improve grid reliability. Packetized Energy Management (PEM) is a method for coordinating DERs, such as thermostatically controlled loads (TCLs) and electric vehicles, within customer quality-of-service (QoS) limits. In PEM, a DER uses local information to offer flexibility by sending a request to the DER coordinator to turn-ON or turn-OFF. Much work has focused on modeling and analyzing aggregations of DERs under PEM with fixed packet durations and only turn-ON requests. Different recent efforts to enable variable packet lengths have shown an increase in available flexibility and ramping capability, but have not been modeled in aggregate, which limits systematic analyses. To address this issue, this paper presents a new aggregate bin-based (macro) model of PEM loads that incorporates both turn-ON and turn-OFF request features, enabling the model to accurately characterize the capability of the fleet of DERs to track a power reference signal, population temperature dynamics, aggregate request rates, and variable packet lengths. Simulation-based validation is performed against an agent-based (micro) model to evaluate robustness and quantify model accuracy. Finally, the distribution of variable packet lengths from macro-model simulations are applied to inform past work on PEM with randomized packet lengths

eess.SY

Comparative Analysis of Quantum and Classical Support Vector Classifiers for Software Bug Prediction: An Exploratory Study

Purpose: Quantum computing promises to transform problem-solving across various domains with rapid and practical solutions. Within Software Evolution and Maintenance, Quantum Machine Learning (QML) remains mostly an underexplored domain, particularly in addressing challenges such as detecting buggy software commits from code repositories. Methods: In this study, we investigate the practical application of Quantum Support Vector Classifiers (QSVC) for detecting buggy software commits across 14 open-source software projects with diverse dataset sizes encompassing 30,924 data instances. We compare the QML algorithm PQSVC (Pegasos QSVC) and QSVC against the classical Support Vector Classifier (SVC). Our technique addresses large datasets in QSVC algorithms by dividing them into smaller subsets. We propose and evaluate an aggregation method to combine predictions from these models to detect the entire test dataset. We also introduce an incremental testing methodology to overcome the difficulties of quantum feature mapping during the testing approach. Results: The study shows the effectiveness of QSVC and PQSVC in detecting buggy software commits. The aggregation technique successfully combines predictions from smaller data subsets, enhancing the overall detection accuracy for the entire test dataset. The incremental testing methodology effectively manages the challenges associated with quantum feature mapping during the testing process. Conclusion: We contribute to the advancement of QML algorithms in defect prediction, unveiling the potential for further research in this domain. The specific scenario of the Short-Term Activity Frame (STAF) highlights the early detection of buggy software commits during the initial developmental phases of software systems, particularly when dataset sizes remain insufficient to train machine learning models.

cs.SE

Quantum vs. Classical Machine Learning Algorithms for Software Defect Prediction: Challenges and Opportunities

Software defect prediction is a critical aspect of software quality assurance, as it enables early identification and mitigation of defects, thereby reducing the cost and impact of software failures. Over the past few years, quantum computing has risen as an exciting technology capable of transforming multiple domains; Quantum Machine Learning (QML) is one of them. QML algorithms harness the power of quantum computing to solve complex problems with better efficiency and effectiveness than their classical counterparts. However, research into its application in software engineering to predict software defects still needs to be explored. In this study, we worked to fill the research gap by comparing the performance of three QML and five classical machine learning (CML) algorithms on the 20 software defect datasets. Our investigation reports the comparative scenarios of QML vs. CML algorithms and identifies the better-performing and consistent algorithms to predict software defects. We also highlight the challenges and future directions of employing QML algorithms in real software defect datasets based on the experience we faced while performing this investigation. The findings of this study can help practitioners and researchers further progress in this research domain by making software systems reliable and bug-free.

cs.SE

Simulating polaritonic ground states on noisy quantum devices

The recent advent of quantum algorithms for noisy quantum devices offers a new route toward simulating strong light-matter interactions of molecules in optical cavities for polaritonic chemistry. In this work, we introduce a general framework for simulating electron-photon coupled systems on small, noisy quantum devices. This method is based on the variational quantum eigensolver (VQE) with the polaritonic unitary coupled cluster (PUCC) ansatz. To achieve chemical accuracy, we exploit various symmetries in qubit reduction methods, such as electron-photon parity, and use recently developed error mitigation schemes, such as the reference zero-noise extrapolation method. We explore the robustness of the VQE-PUCC approach across a diverse set of regimes for the bond length, cavity frequency, and coupling strength of the H$_2$ molecule in an optical cavity. To quantify the performance, we measure two properties: ground-state energy, fundamentally relevant to chemical reactivity, and photon number, an experimentally accessible general indicator of electron-photon correlation.

quant-ph

Matrix Model simulations using Quantum Computing, Deep Learning, and Lattice Monte Carlo

Matrix quantum mechanics plays various important roles in theoretical physics, such as a holographic description of quantum black holes. Understanding quantum black holes and the role of entanglement in a holographic setup is of paramount importance for the development of better quantum algorithms (quantum error correction codes) and for the realization of a quantum theory of gravity. Quantum computing and deep learning offer us potentially useful approaches to study the dynamics of matrix quantum mechanics. In this paper we perform a systematic survey for quantum computing and deep learning approaches to matrix quantum mechanics, comparing them to Lattice Monte Carlo simulations. In particular, we test the performance of each method by calculating the low-energy spectrum.

quant-ph

Quantum Computing for Inflationary, Dark Energy and Dark Matter Cosmology

Cosmology is in an era of rapid discovery especially in areas related to dark energy, dark matter and inflation. Quantum cosmology treats the cosmology quantum mechanically and is important when quantum effects need to be accounted for, especially in the very early Universe. Quantum computing is an emerging new method of computing which excels in simulating quantum systems. Quantum computing may have some advantages when simulating quantum cosmology, especially because the Euclidean action of gravity is unbounded from below, making the implementation of Monte Carlo simulation problematic. In this paper we present several examples of the application of quantum computing to cosmology. These include a dark energy model that is related to Kaluza-Klein theory, dark matter models where the dark sector is described by a self interacting gauge field or a conformal scalar field and an inflationary model with a slow roll potential. We implement quantum computations in the IBM QISKit software framework and show how to apply the Variational Quantum Eigensolver (VQE) and Evolution of Hamiltonian (EOH) algorithms to solve the Wheeler-DeWitt equation that can be used to describe the cosmology in the mini-superspace approximation. We find excellent agreement with classical computing results and describe the accuracy of the different quantum algorithms. Finally we discuss how these methods can be scaled to larger problems going beyond the mini-superspace approximation where the quantum computer may exceed the performance of classical computation.

quant-ph

Z3 gauge theory coupled to fermions and quantum computing

We study the Z3 gauge theory with fermions on the quantum computer using the Variational Quantum Eigensolver (VQE) algorithm with IBM QISKit software. Using up to 9 qubits we are able to obtain accurate results for the ground state energy. Introducing nonzero chemical potential we are able to determine the Equation of State (EOS) for finite density on the quantum computer. We discuss possible realizations of quantum advantage for this system over classical computers with regards to finite density simulations and the fermion sign problem.

quant-ph

Morse Potential on a Quantum Computer for Molecules and Supersymmetric Quantum Mechanics

In this paper we discuss the Morse potential on a quantum computer. The Morse potential is useful to describe diatomic molecules and has a finite number of bound states which can be measured through spectroscopy. It is also a example of an exactly soluble potential using supersymmetric quantum mechanics. Using the the supersymmetric quantum mechanics formalism one can derive a heirachy of Hamiltonians such that the ground state of the next rung on the heirarchy yeids the first excited state of the hamiltonian below it. Using this method one can determine all the states of the Morse potential by calculating all the ground states of the sequence of Hamiltonians in the heirarchy. We use the IBM QISKit software together with the Variational Quantum Eiegensolver (VQE) algorithm to calculate the ground state and first excited state energy of the Morse potential and find agreement with the exact expression for the bound state energies of the Morse Potential. We analyze different optimizers to study the numerical effect on the calculations. Finally we perform quantum computations for diatomic and triatomic molecules to illustrate the application of these techniques on near term quantum computers and find excellent agreement with experimental data.

quant-ph