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Improved understanding of charge-transport in single molecules is essential for harnessing the potential of molecules e.g. as circuit components at the ultimate size limit. However, interpretation and analysis of the large, stochastic…

Mesoscale and Nanoscale Physics · Physics 2020-08-06 Nathan D. Bamberger , Jeffrey A. Ivie , Keshaba N. Parida , Dominic V. McGrath , Oliver L. A. Monti

Detecting influential features in non-linear and/or high-dimensional data is a challenging and increasingly important task in machine learning. Variable selection methods have thus been gaining much attention as well as post-selection…

Statistics Theory · Mathematics 2021-06-18 Tobias Freidling , Benjamin Poignard , Héctor Climente-González , Makoto Yamada

Stochastic convex optimization, where the objective is the expectation of a random convex function, is an important and widely used method with numerous applications in machine learning, statistics, operations research and other areas. We…

Machine Learning · Computer Science 2016-11-23 Vitaly Feldman , Cristobal Guzman , Santosh Vempala

In this paper, we consider the problem of invariant set computation for black-box switched linear systems using merely a finite set of observations of system trajectories. In particular, this paper focuses on polyhedral invariant sets. We…

Systems and Control · Electrical Eng. & Systems 2020-12-18 Zheming Wang , Raphaël M. Jungers

Quantum measurements are crucial for quantum technologies and give rise to some of the most classically counter-intuitive quantum phenomena. As such, the ability to certify the presence of genuinely non-classical joint measurements in a…

Quantum Physics · Physics 2019-05-13 Ciarán M. Lee

Preferential Bayesian optimization allows optimization of objectives that are either expensive or difficult to measure directly, by relying on a minimal number of comparative evaluations done by a human expert. Generating candidate…

Computational models are quantitative representations of systems. By analyzing and comparing the outputs of such models, it is possible to gain a better understanding of the system itself. Though as the complexity of model outputs…

Machine Learning · Computer Science 2022-12-13 Colin G. Cess , Stacey D. Finley

Quantum computation offers a promising new kind of information processing, where the non-classical features of quantum mechanics can be harnessed and exploited. A number of models of quantum computation exist, including the now well-studied…

Quantum Physics · Physics 2011-08-03 H. J. Briegel , D. E. Browne , W. Dür , R. Raussendorf , M. Van den Nest

In structured prediction problems where we have indirect supervision of the output, maximum marginal likelihood faces two computational obstacles: non-convexity of the objective and intractability of even a single gradient computation. In…

Machine Learning · Statistics 2016-08-11 Aditi Raghunathan , Roy Frostig , John Duchi , Percy Liang

Many statistical problems include model parameters that are defined as the solutions to optimization sub-problems. These include classical approaches such as profile likelihood as well as modern applications involving flow networks or…

Methodology · Statistics 2025-03-17 Cheng Zeng , Yaozhi Yang , Jason Xu , Leo L Duan

We study the problem of observing quantum collective phenomena emerging from large numbers of measurements. These phenomena are difficult to observe in conventional experiments because, in order to distinguish the effects of measurement…

Quantum Physics · Physics 2024-07-22 Samuel J. Garratt , Ehud Altman

The construction of low-discrepancy sets, used for uniform sampling and numerical integration, has recently seen great improvements based on optimization and machine learning techniques. However, these methods are computationally expensive,…

Optimization and Control · Mathematics 2025-11-14 François Clément , Linhang Huang , Woorim Lee , Cole Smidt , Braeden Sodt , Xuan Zhang

Diffusion probabilistic models (DPMs) have emerged as a promising technique in generative modeling. The success of DPMs relies on two ingredients: time reversal of diffusion processes and score matching. In view of possibly unguaranteed…

Machine Learning · Computer Science 2024-10-15 Wenpin Tang , Hanyang Zhao

One of the major challenges in the Bayesian solution of inverse problems governed by partial differential equations (PDEs) is the computational cost of repeatedly evaluating numerical PDE models, as required by Markov chain Monte Carlo…

Computation · Statistics 2016-05-03 Tiangang Cui , Youssef M. Marzouk , Karen E. Willcox

We reconstruct finite-dimensional quantum theory with superselection rules, which can describe hybrid quantum-classical systems, from four purely operational postulates: symmetric sharpness, complete mixing, filtering, and local equality.…

Quantum Physics · Physics 2026-05-26 Kenji Nakahira

Computational techniques are extensively applied in nonlinear science. However, while the use of computers for research has been expressive, the evaluation of numerical results does not grow in the same pace. Hammel et al. (Journal of…

Numerical Analysis · Computer Science 2016-12-08 B. C. Silva , F. L. Milani , E. G. Nepomuceno , S. A. M. Martins , G. F. V. Amaral

An operationally well-defined delayed-choice quantum-eraser experiment is proposed, realizing a genuine delayed choice within presently available quantum-optical technology. A multimode quantum memory supplies a controlled and verifiable…

Quantum Physics · Physics 2025-12-23 Taku Ohwada

Beginning with the projectively invariant method for linear programming, interior point methods have led to powerful algorithms for many difficult computing problems, in combinatorial optimization, logic, number theory and non-convex…

Numerical Analysis · Computer Science 2014-12-11 Narendra Karmarkar

Our world is full of asymmetries. Gravity and wind can make reaching a place easier than coming back. Social artifacts such as genealogy charts and citation graphs are inherently directed. In reinforcement learning and control, optimal…

Machine Learning · Computer Science 2022-10-05 Tongzhou Wang , Phillip Isola

We develop a systematic method to calculate the trace distance between two reduced density matrices in 1+1 dimensional quantum field theories. The approach exploits the path integral representation of the reduced density matrices and an ad…

High Energy Physics - Theory · Physics 2019-04-17 Jiaju Zhang , Paola Ruggiero , Pasquale Calabrese