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A nonlinear kernel-free soft quadratic surface support vector machine model with 0-1 loss function ($L_{0/1}$-SQSSVM) is proposed for binary classification problems, which is non-convex discontinuous. We are devoted to establishing the…

Optimization and Control · Mathematics 2026-05-12 Guoping Li , Wen Song

Computed tomography (CT) has been developed as a non-destructive technique for observing minute internal images of samples. It has been difficult to obtain photo-realistic (clean or clear) CT images due to various unwanted artifacts…

Quantum Physics · Physics 2023-09-12 Kyungtaek Jun

We present an efficient quantum algorithm for beyond-Born-Oppenheimer molecular energy computations. Our approach combines the quantum full configuration interaction method with the nuclear orbital plus molecular orbital (NOMO) method. We…

Quantum Physics · Physics 2016-02-24 Libor Veis , Jakub Višňák , Hiroaki Nishizawa , Hiromi Nakai , Jiří Pittner

Parameterized quantum circuits (PQCs) play an essential role in the application of variational quantum algorithms (VQAs) in noisy intermediate-scale quantum (NISQ) devices. The PQCs are a leading candidate to achieve a quantum advantage in…

Quantum Physics · Physics 2025-10-10 Joona V. Pankkonen , Matti Raasakka , Andrea Marchesin , Ilkka Tittonen

Convex quadratic programming (QP) is an important class of optimization problem with wide applications in practice. The classic QP solvers are based on either simplex or barrier method, both of which suffer from the scalability issue…

Optimization and Control · Mathematics 2025-07-16 Haihao Lu , Jinwen Yang

Motivated by the problem of online canonical correlation analysis, we propose the \emph{Stochastic Scaled-Gradient Descent} (SSGD) algorithm for minimizing the expectation of a stochastic function over a generic Riemannian manifold. SSGD…

Machine Learning · Statistics 2022-01-25 Chris Junchi Li , Michael I. Jordan

We consider Markov Decision Problems defined over continuous state and action spaces, where an autonomous agent seeks to learn a map from its states to actions so as to maximize its long-term discounted accumulation of rewards. We address…

Machine Learning · Computer Science 2018-04-23 Alec Koppel , Ekaterina Tolstaya , Ethan Stump , Alejandro Ribeiro

Quantization reduces the precision of deep neural networks to lower model size and computational demands, but often at the expense of accuracy. Fully quantized models can suffer significant accuracy degradation, and resource-constrained…

Machine Learning · Computer Science 2026-02-03 Nikolaos Louloudakis , Ajitha Rajan

In the context of Noisy Intermediate-Scale Quantum (NISQ) computing, parameterized quantum circuits (PQCs) represent a promising paradigm for tackling challenges in quantum sensing, optimal control, optimization, and machine learning on…

Quantum Physics · Physics 2024-08-13 Dantong Li , Dikshant Dulal , Mykhailo Ohorodnikov , Hanrui Wang , Yongshan Ding

We propose Scalable Quantum Molecular Generation (SQMG), a variational quantum-circuit for sampling molecular graphs using chemical priors on atoms and bonds. SQMG assigns a fixed 3-qubit register to each heavy atom and reuses a single…

Quantum Kernel Estimation (QKE) is a technique based on leveraging a quantum computer to estimate a kernel function that is classically difficult to calculate, which is then used by a classical computer for training a Support Vector Machine…

Quantum Physics · Physics 2023-08-01 Marco Russo , Edoardo Giusto , Bartolomeo Montrucchio

We propose a sequential minimal optimization method for quantum-classical hybrid algorithms, which converges faster, is robust against statistical error, and is hyperparameter-free. Specifically, the optimization problem of the…

Quantum Physics · Physics 2020-11-04 Ken M. Nakanishi , Keisuke Fujii , Synge Todo

We develop a Vector Quantized Spectral Clustering (VQSC) algorithm that is a combination of Spectral Clustering (SC) and Vector Quantization (VQ) sampling for grouping Soybean genomes. The inspiration here is to use SC for its accuracy and…

Quantitative Methods · Quantitative Biology 2018-10-02 Aditya A. Shastri , Kapil Ahuja , Milind B. Ratnaparkhe , Aditya Shah , Aishwary Gagrani , Anant Lal

Hamiltonian simulation is known to be one of the fundamental building blocks of a variety of quantum algorithms such as its most immediate application, that of simulating many-body systems to extract their physical properties. In this work,…

Quantum Physics · Physics 2024-06-21 Kouhei Nakaji , Mohsen Bagherimehrab , Alan Aspuru-Guzik

In this work we investigate methods to improve the efficiency and scalability of quantum algorithms for quantum chemistry applications. We propose a transformation of the electronic structure Hamiltonian in the second quantization framework…

In this work, we introduce a novel Quadratic Binary Optimization (QBO) framework for training a quantized neural network. The framework enables the use of arbitrary activation and loss functions through spline interpolation, while Forward…

Machine Learning · Computer Science 2025-12-09 Wenxin Li , Chuan Wang , Hongdong Zhu , Qi Gao , Yin Ma , Hai Wei , Kai Wen

Quantum-phase-estimation algorithms are critical subroutines in many applications for quantum computers and in quantum-metrology protocols. These algorithms estimate the unknown strength of a unitary evolution. By using coherence or…

Quantum Physics · Physics 2023-03-06 Joseph G. Smith , Crispin H. W. Barnes , David R. M. Arvidsson-Shukur

Minimizing a convex function over the spectrahedron, i.e., the set of all positive semidefinite matrices with unit trace, is an important optimization task with many applications in optimization, machine learning, and signal processing. It…

Optimization and Control · Mathematics 2016-05-23 Dan Garber

We present a quantum algorithm for simulating the time evolution generated by any bounded, time-dependent operator $-A$ with non-positive logarithmic norm, thereby serving as a natural generalization of the Hamiltonian simulation problem.…

Quantum Physics · Physics 2025-09-15 Guang Hao Low , Rolando D. Somma

In this work, we consider solving optimization problems with a stochastic objective and deterministic equality constraints. We propose a Trust-Region Sequential Quadratic Programming method to find both first- and second-order stationary…

Optimization and Control · Mathematics 2024-09-27 Yuchen Fang , Sen Na , Michael W. Mahoney , Mladen Kolar