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Daya Gaur

Publications and source records attributed to Daya Gaur.

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Robust Treasure Hunt in Anonymous Graphs with Quantum Pebbles by Oblivious Agents

We study how to find a hidden treasure in anonymous graphs using an agent that has no persistent memory. The nodes are indistinguishable, and only edges have local port numbers. Classical pebbles placed by an oracle cannot guide an oblivious agent to the treasure. We introduce \emph{quantum pebbles}, which are sources that emit qubits in a fixed (unknown) state, encoding at every node the outgoing port on the shortest path to the treasure. By measuring in several non-orthogonal bases, an oblivious agent recovers the port and can reach the treasure in $D$ steps using $D$ quantum pebbles. This requires $O(\Delta^{3}(\log D + \log \Delta))$ measurements per node, where $\Delta$ is the maximum degree. We further establish \emph{error robustness}, distinguishing two models of state preparation error. Under \emph{per-node persistent} error, where a device returns the same faulty encoding on every read, a single mislabelled coloured pebble can trap an oblivious agent in an infinite loop and every randomized strategy decays exponentially in $D$. Quantum pebbles inherit the same exponential decay. Under \emph{per-emission} error, the intended encoding is correct, but each emitted qubit independently changes state as $\rho = (1-e)\,\lvert\psi\rangle\langle\psi\rvert + e\,\sigma $ for an arbitrary noise matrix $\sigma$. Here the quantum protocol is provably robust. A threshold decoding rule with $O((\log D + \log \Delta)/\gamma^{2})$ measurements per basis, where $\gamma = (1-e) - \delta_e$ and $\delta_e = (1-e)\delta + e$, has success probability close to $1$ as $D \to \infty$, provided $e < e^{*} = \sin^2(\pi/2\Delta)/(1+\sin^2(\pi/2\Delta))$. The separation that we establish is thus among quantum pebbles with per-emission error and a persistent marker.

quant-ph

Quantum Algorithms for Optimal Power Flow

This paper explores the use of quantum computing, specifically the use of HHL and VQLS algorithms, to solve optimal power flow problem in electrical grids. We investigate the effectiveness of these quantum algorithms in comparison to classical methods. The simulation results presented here which substantially improve the results in [1] indicate that quantum approaches yield similar solutions and optimal costs compared to classical methods, suggesting the potential use case of quantum computing for power system optimization.

quant-ph

Quantum Active Learning for Structural Determination of Doped Nanoparticles -- a Case Study of 4Al@Si$_{11}$

Active learning (AL) has been widely applied in chemistry and materials science. In this work we propose a quantum active learning (QAL) method for automatic structural determination of doped nanoparticles, where quantum machine learning (QML) models for regression are used iteratively to indicate new structures to be calculated by DFT or DFTB and this new data acquisition is used to retrain the QML models. The QAL method is implemented in the Quantum Machine Learning Software/Agent for Material Design and Discovery (QMLMaterial), whose aim is using an artificial agent (defined by QML regression algorithms) that chooses the next doped configuration to be calculated that has a higher probability of finding the optimum structure. The QAL uses a quantum Gaussian process with a fidelity quantum kernel as well as the projected quantum kernel and different quantum circuits. For comparison, classical AL was used with a classical Gaussian process with different classical kernels. The presented QAL method was applied in the structural determination of doped Si$_{11}$ with 4 Al (4Al@Si$_{11}$) and the results indicate the QAL method is able to find the optimum 4Al@Si$_{11}$ structure. The aim of this work is to present the QAL method -- formulated in a noise-free quantum computing framework -- for automatic structural determination of doped nanoparticles and materials defects.

quant-ph

A hybrid quantum solver for the Lorenz system

We develop a hybrid classical-quantum method for solving the Lorenz system. We use the forward Euler method to discretize the system in time, transforming it into a system of equations. This set of equations is solved using the Variational Quantum Linear Solver (VQLS) algorithm. We present numerical results comparing the hybrid method with the classical approach for solving the Lorenz system. The simulation results demonstrate that the VQLS method can effectively compute solutions comparable to classical methods. The method is easily extended to solving similar nonlinear differential equations.

quant-ph

Exploring Quantum Active Learning for Materials Design and Discovery

The meeting of artificial intelligence (AI) and quantum computing is already a reality; quantum machine learning (QML) promises the design of better regression models. In this work, we extend our previous studies of materials discovery using classical active learning (AL), which showed remarkable economy of data, to explore the use of quantum algorithms within the AL framework (QAL) as implemented in the MLChem4D and QMLMaterials codes. The proposed QAL uses quantum support vector regressor (QSVR) or a quantum Gaussian process regressor (QGPR) with various quantum kernels and different feature maps. Data sets include perovskite properties (piezoelectric coefficient, band gap, energy storage) and the structure optimization of a doped nanoparticle (3Al@Si11) chosen to compare with classical AL results. Our results revealed that the QAL method improved the searches in most cases, but not all, seemingly correlated with the roughness of the data. QAL has the potential of finding optimum solutions, within chemical space, in materials science and elsewhere in chemistry.

quant-ph

A Hybrid Quantum Algorithm for Load Flow

The goal of the load flow study is to ensure that electrical power is delivered efficiently and reliably to end-users while maintaining the stability and security of the power system. Newton-Raphson is a numerical method used widely for load flow analysis. One of the most computationally expensive steps in this method is an equation-solving step. We propose to replace this step with HHL, a quantum algorithm for solving linear systems of equations. HHL is exponentially faster, but with caveats. In this study, a hybrid quantum algorithm is proposed for solving load flow. The Newton-Raphson method is used as a benchmark to compare the performance of the hybrid quantum algorithm. Although the simulation of the hybrid quantum algorithm takes much time, these preliminary results are encouraging and point to the potential for the use of quantum algorithms to develop hybrid quantum algorithms for load flow analysis and related problems.

eess.SY

Barzilai and Borwein conjugate gradient method equipped with a non-monotone line search technique and its application on non-negative matrix factorization

In this paper, we propose a new non-monotone conjugate gradient method for solving unconstrained nonlinear optimization problems. We first modify the non-monotone line search method by introducing a new trigonometric function to calculate the non-monotone parameter, which plays an essential role in the algorithm's efficiency. Then, we apply a convex combination of the Barzilai-Borwein method for calculating the value of step size in each iteration. Under some suitable assumptions, we prove that the new algorithm has the global convergence property. The efficiency and effectiveness of the proposed method are determined in practice by applying the algorithm to some standard test problems and non-negative matrix factorization problems.

math.OC

Testing Unsatisfiability of Constraint Satisfaction Problems via Tensor Products

We study the design of stochastic local search methods to prove unsatisfiability of a constraint satisfaction problem (CSP). For a binary CSP, such methods have been designed using the microstructure of the CSP. Here, we develop a method to decompose the microstructure into graph tensors. We show how to use the tensor decomposition to compute a proof of unsatisfiability efficiently and in parallel. We also offer substantial empirical evidence that our approach improves the praxis. For instance, one decomposition yields proofs of unsatisfiability in half the time without sacrificing the quality. Another decomposition is twenty times faster and effective three-tenths of the times compared to the prior method. Our method is applicable to arbitrary CSPs using the well known dual and hidden variable transformations from an arbitrary CSP to a binary CSP.

cs.AI