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Register a new userOn Learning Hamiltonian Systems from Data
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Concise, accurate descriptions of physical systems through their conserved quantities abound in the natural sciences. In data science, however, current research often focuses on regression problems, without routinely incorporating additional assumptions about the system that generated the data. Here, we propose to explore a particular type of underlying structure in the data: Hamiltonian systems, where an energy is conserved. Given a collection of observations of such a Hamiltonian system over time, we extract phase space coordinates and a Hamiltonian function of them that acts as the generator of the system dynamics. The approach employs an autoencoder neural network component to estimate the transformation from observations to the phase space of a Hamiltonian system. An additional neural network component is used to approximate the Hamiltonian function on this constructed space, and the two components are trained jointly. As an alternative approach, we also demonstrate the use of Gaussian processes for the estimation of such a Hamiltonian. After two illustrative examples, we extract an underlying phase space as well as the generating Hamiltonian from a collection of movies of a pendulum. The approach is fully data-driven, and does not assume a particular form of the Hamiltonian function.
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We introduce Roe Neural Networks (RoeNets) that can predict the discontinuity of the hyperbolic conservation laws (HCLs) based on short-term discontinuous and even continuous training data. Our methodology is inspired by Roe approximate Riemann solver (P. L. Roe, J. Comput. Phys., vol. 43, 1981, pp. 357--372), which is one of the most fundamental HCLs numerical solvers. In order to accurately solve the HCLs, Roe argues the need to construct a Roe matrix that fulfills Property U, including diagonalizable with real eigenvalues, consistent with the exact Jacobian, and preserving conserved quantities. However, the construction of such matrix cannot be achieved by any general numerical method. Our model made a breakthrough improvement in solving the HCLs by applying Roe solver under a neural network perspective. To enhance the expressiveness of our model, we incorporate pseudoinverses into a novel context to enable a hidden dimension so that we are flexible with the number of parameters. The ability of our model to predict long-term discontinuity from a short window of continuous training data is in general considered impossible using traditional machine learning approaches. We demonstrate that our model can generate highly accurate predictions of evolution of convection without dissipation and the discontinuity of hyperbolic systems from smooth training data.
Passivity-based control (PBC) for port-Hamiltonian systems provides an intuitive way of achieving stabilization by rendering a system passive with respect to a desired storage function. However, in most instances the control law is obtained without any performance considerations and it has to be calculated by solving a complex partial differential equation (PDE). In order to address these issues we introduce a reinforcement learning approach into the energy-balancing passivity-based control (EB-PBC) method, which is a form of PBC in which the closed-loop energy is equal to the difference between the stored and supplied energies. We propose a technique to parameterize EB-PBC that preserves the systemss PDE matching conditions, does not require the specification of a global desired Hamiltonian, includes performance criteria, and is robust to extra non-linearities such as control input saturation. The parameters of the control law are found using actor-critic reinforcement learning, enabling learning near-optimal control policies satisfying a desired closed-loop energy landscape. The advantages are that near-optimal controllers can be generated using standard energy shaping techniques and that the solutions learned can be interpreted in terms of energy shaping and damping injection, which makes it possible to numerically assess stability using passivity theory. From the reinforcement learning perspective, our proposal allows for the class of port-Hamiltonian systems to be incorporated in the actor-critic framework, speeding up the learning thanks to the resulting parameterization of the policy. The method has been successfully applied to the pendulum swing-up problem in simulations and real-life experiments.
We investigate the difference between the velocity Verlet and the Liouville-operator-derived (LOD) algorithms by studying two non-Hamiltonian systems, one dissipative and the other conservative, for which the Jacobian of the transformation can be determined exactly. For the two systems, we demonstrate that (1) the velocity Verlet scheme fails to integrate the former system while the first- and second-order LOD schemes succeed, (2) some first-order LOD fails to integrate the latter system while the velocity Verlet and the other first- and second-order schemes succeed. We have shown that the LOD schemes are stable for the former system by determining the explicit forms of the shadow Hamiltonians which are exactly conserved by the schemes. We have shown that Jacobian of the velocity Verlet scheme for the former system and that of the first-order LOD scheme for the latter system are always smaller than the exact values, and therefore, the schemes are unstable. The decomposition-order dependence of LOD schemes is also considered.
We discuss the alternative algebraic structures on the manifold of quantum states arising from alternative Hermitian structures associated with quantum bi-Hamiltonian systems. We also consider the consequences at the level of the Heisenberg picture in terms of deformations of the associative product on the space of observables.
Although deep-learning has been successfully applied in a variety of science and engineering problems owing to its strong high-dimensional nonlinear mapping capability, it is of limited use in scientific knowledge discovery. In this work, we propose a deep-learning based framework to discover the macroscopic governing equation of viscous gravity current based on high-resolution microscopic simulation data without the need for prior knowledge of underlying terms. For two typical scenarios with different viscosity ratios, the deep-learning based equations exactly capture the same dominated terms as the theoretically derived equations for describing long-term asymptotic behaviors, which validates the proposed framework. Unknown macroscopic equations are then obtained for describing short-term behaviors, and hidden mechanisms are eventually discovered with deep-learned explainable compensation terms and corresponding coefficients. Consequently, the presented deep-learning framework shows considerable potential for discovering unrevealed intrinsic laws in scientific semantic space from raw experimental or simulation results in data space.
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