We consider the computations of the action ground state for a rotating nonlinear Schr\"odinger equation. It reads as a minimization of the action functional under the Nehari constraint. In the focusing case, we identify an equivalent formulation of the problem which simplifies the constraint. Based on it, we propose a normalized gradient flow method with asymptotic Lagrange multiplier and establish the energy-decaying property. Popular optimization methods are also applied to gain more efficiency. In the defocusing case, we prove that the ground state can be obtained by the unconstrained minimization. Then the direct gradient flow method and unconstrained optimization methods are applied. Numerical experiments show the convergence and accuracy of the proposed methods in both cases, and comparisons on the efficiency are discussed. Finally, the relation between the action and the energy ground states are numerically investigated.
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We present a space--time ultra-weak discontinuous Galerkin discretization of the linear Schr\"odinger equation with variable potential. The proposed method is well-posed and quasi-optimal in mesh-dependent norms for very general discrete spaces. Optimal~$h$-convergence error estimates are derived for the method when test and trial spaces are chosen either as piecewise polynomials, or as a novel quasi-Trefftz polynomial space. The latter allows for a substantial reduction of the number of degrees of freedom and admits piecewise-smooth potentials. Several numerical experiments validate the accuracy and advantages of the proposed method.
We consider minimizing functions for which it is expensive to compute the (possibly stochastic) gradient. Such functions are prevalent in reinforcement learning, imitation learning and adversarial training. Our target optimization framework uses the (expensive) gradient computation to construct surrogate functions in a \emph{target space} (e.g. the logits output by a linear model for classification) that can be minimized efficiently. This allows for multiple parameter updates to the model, amortizing the cost of gradient computation. In the full-batch setting, we prove that our surrogate is a global upper-bound on the loss, and can be (locally) minimized using a black-box optimization algorithm. We prove that the resulting majorization-minimization algorithm ensures convergence to a stationary point of the loss. Next, we instantiate our framework in the stochastic setting and propose the $SSO$ algorithm, which can be viewed as projected stochastic gradient descent in the target space. This connection enables us to prove theoretical guarantees for $SSO$ when minimizing convex functions. Our framework allows the use of standard stochastic optimization algorithms to construct surrogates which can be minimized by any deterministic optimization method. To evaluate our framework, we consider a suite of supervised learning and imitation learning problems. Our experiments indicate the benefits of target optimization and the effectiveness of $SSO$.
In modern scientific experiments, we frequently encounter data that have large dimensions, and in some experiments, such high dimensional data arrive sequentially rather than full data being available all at a time. We develop multiple testing procedures with simultaneous control of false discovery and nondiscovery rates when $m$-variate data vectors $\mathbf{X}_1, \mathbf{X}_2, \dots$ are observed sequentially or in groups and each coordinate of these vectors leads to a hypothesis testing. Existing multiple testing methods for sequential data uses fixed stopping boundaries that do not depend on sample size, and hence, are quite conservative when the number of hypotheses $m$ is large. We propose sequential tests based on adaptive stopping boundaries that ensure shrinkage of the continue sampling region as the sample size increases. Under minimal assumptions on the data sequence, we first develop a test based on an oracle test statistic such that both false discovery rate (FDR) and false nondiscovery rate (FNR) are nearly equal to some prefixed levels with strong control. Under a two-group mixture model assumption, we propose a data-driven stopping and decision rule based on local false discovery rate statistic that mimics the oracle rule and guarantees simultaneous control of FDR and FNR asymptotically as $m$ tends to infinity. Both the oracle and the data-driven stopping times are shown to be finite (i.e., proper) with probability 1 for all finite $m$ and converge to a finite constant as $m$ grows to infinity. Further, we compare the data-driven test with the existing gap rule proposed in He and Bartroff (2021) and show that the ratio of the expected sample sizes of our method and the gap rule tends to zero as $m$ goes to infinity. Extensive analysis of simulated datasets as well as some real datasets illustrate the superiority of the proposed tests over some existing methods.
In financial engineering, prices of financial products are computed approximately many times each trading day with (slightly) different parameters in each calculation. In many financial models such prices can be approximated by means of Monte Carlo (MC) simulations. To obtain a good approximation the MC sample size usually needs to be considerably large resulting in a long computing time to obtain a single approximation. In this paper we introduce a new approximation strategy for parametric approximation problems including the parametric financial pricing problems described above. A central aspect of the approximation strategy proposed in this article is to combine MC algorithms with machine learning techniques to, roughly speaking, learn the random variables (LRV) in MC simulations. In other words, we employ stochastic gradient descent (SGD) optimization methods not to train parameters of standard artificial neural networks (ANNs) but to learn random variables appearing in MC approximations. We numerically test the LRV strategy on various parametric problems with convincing results when compared with standard MC simulations, Quasi-Monte Carlo simulations, SGD-trained shallow ANNs, and SGD-trained deep ANNs. Our numerical simulations strongly indicate that the LRV strategy might be capable to overcome the curse of dimensionality in the $L^\infty$-norm in several cases where the standard deep learning approach has been proven not to be able to do so. This is not a contradiction to lower bounds established in the scientific literature because this new LRV strategy is outside of the class of algorithms for which lower bounds have been established in the scientific literature. The proposed LRV strategy is of general nature and not only restricted to the parametric financial pricing problems described above, but applicable to a large class of approximation problems.
The problem of anticipating human actions is an inherently uncertain one. However, we can reduce this uncertainty if we have a sense of the goal that the actor is trying to achieve. Here, we present an action anticipation model that leverages goal information for the purpose of reducing the uncertainty in future predictions. Since we do not possess goal information or the observed actions during inference, we resort to visual representation to encapsulate information about both actions and goals. Through this, we derive a novel concept called abstract goal which is conditioned on observed sequences of visual features for action anticipation. We design the abstract goal as a distribution whose parameters are estimated using a variational recurrent network. We sample multiple candidates for the next action and introduce a goal consistency measure to determine the best candidate that follows from the abstract goal. Our method obtains impressive results on the very challenging Epic-Kitchens55 (EK55), EK100, and EGTEA Gaze+ datasets. We obtain absolute improvements of +13.69, +11.24, and +5.19 for Top-1 verb, Top-1 noun, and Top-1 action anticipation accuracy respectively over prior state-of-the-art methods for seen kitchens (S1) of EK55. Similarly, we also obtain significant improvements in the unseen kitchens (S2) set for Top-1 verb (+10.75), noun (+5.84) and action (+2.87) anticipation. Similar trend is observed for EGTEA Gaze+ dataset, where absolute improvement of +9.9, +13.1 and +6.8 is obtained for noun, verb, and action anticipation. It is through the submission of this paper that our method is currently the new state-of-the-art for action anticipation in EK55 and EGTEA Gaze+ //competitions.codalab.org/competitions/20071#results Code available at //github.com/debadityaroy/Abstract_Goal
Highly oscillatory integrals of composite type arise in electronic engineering and their calculations is a challenging problem. In this paper, we propose two Gaussian quadrature rules for computing such integrals. The first one is constructed based on the classical theory of orthogonal polynomials and its nodes and weights can be computed efficiently by using tools of numerical linear algebra. We show that the rate of convergence of this rule depends solely on the regularity of the non-oscillatory part of the integrand. The second one is constructed with respect to a sign-changing function and the classical theory of Gaussian quadrature can not be used anymore. We explore theoretical properties of this Gaussian quadrature, including the trajectories of the quadrature nodes and the convergence rate of these nodes to the endpoints of the integration interval, and prove its asymptotic error estimate under suitable hypotheses. Numerical experiments are presented to demonstrate the performance of the proposed methods.
Quantifying entanglement is an important task by which the resourcefulness of a quantum state can be measured. Here we develop a quantum algorithm that tests for and quantifies the separability of a general bipartite state, by making use of the quantum steering effect, the latter originally discovered by Schr\"odinger. Our separability test consists of a distributed quantum computation involving two parties: a computationally limited client, who prepares a purification of the state of interest, and a computationally unbounded server, who tries to steer the reduced systems to a probabilistic ensemble of pure product states. To design a practical algorithm, we replace the role of the server by a combination of parameterized unitary circuits and classical optimization techniques to perform the necessary computation. The result is a variational quantum steering algorithm (VQSA), which is a modified separability test that is better suited for the capabilities of quantum computers available today. We then simulate our VQSA on noisy quantum simulators and find favorable convergence properties on the examples tested. We also develop semidefinite programs, executable on classical computers, that benchmark the results obtained from our VQSA. Our findings here thus provide a meaningful connection between steering, entanglement, quantum algorithms, and quantum computational complexity theory. They also demonstrate the value of a parameterized mid-circuit measurement in a VQSA and represent a first-of-its-kind application for a distributed VQA.
The theory of Koopman operators allows to deploy non-parametric machine learning algorithms to predict and analyze complex dynamical systems. Estimators such as principal component regression (PCR) or reduced rank regression (RRR) in kernel spaces can be shown to provably learn Koopman operators from finite empirical observations of the system's time evolution. Scaling these approaches to very long trajectories is a challenge and requires introducing suitable approximations to make computations feasible. In this paper, we boost the efficiency of different kernel-based Koopman operator estimators using random projections (sketching). We derive, implement and test the new "sketched" estimators with extensive experiments on synthetic and large-scale molecular dynamics datasets. Further, we establish non asymptotic error bounds giving a sharp characterization of the trade-offs between statistical learning rates and computational efficiency. Our empirical and theoretical analysis shows that the proposed estimators provide a sound and efficient way to learn large scale dynamical systems. In particular our experiments indicate that the proposed estimators retain the same accuracy of PCR or RRR, while being much faster.
A parametric class of trust-region algorithms for unconstrained nonconvex optimization is considered where the value of the objective function is never computed. The class contains a deterministic version of the first-order Adagrad method typically used for minimization of noisy function, but also allows the use of (possibly approximate) second-order information when available. The rate of convergence of methods in the class is analyzed and is shown to be identical to that known for first-order optimization methods using both function and gradients values, recovering existing results for purely-first order variants and improving the explicit dependence on problem dimension. This rate is shown to be essentially sharp. A new class of methods is also presented, for which a slightly worse and essentially sharp complexity result holds. Limited numerical experiments show that the new methods' performance may be comparable to that of standard steepest descent, despite using significantly less information, and that this performance is relatively insensitive to noise.
Many tasks in natural language processing can be viewed as multi-label classification problems. However, most of the existing models are trained with the standard cross-entropy loss function and use a fixed prediction policy (e.g., a threshold of 0.5) for all the labels, which completely ignores the complexity and dependencies among different labels. In this paper, we propose a meta-learning method to capture these complex label dependencies. More specifically, our method utilizes a meta-learner to jointly learn the training policies and prediction policies for different labels. The training policies are then used to train the classifier with the cross-entropy loss function, and the prediction policies are further implemented for prediction. Experimental results on fine-grained entity typing and text classification demonstrate that our proposed method can obtain more accurate multi-label classification results.
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