Deep learning for the semi-classical limit of the Schrödinger equation

Fuente: arXiv
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Auteurs principaux: Huang, Jizu, You, Rukang, Zhou, Tao
Format: Preprint
Publié: 2025
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author Huang, Jizu
You, Rukang
Zhou, Tao
author_facet Huang, Jizu
You, Rukang
Zhou, Tao
contents In this paper, we integrate neural networks and Gaussian wave packets to numerically solve the Schrödinger equation with a smooth potential near the semi-classical limit. Our focus is not only on accurately obtaining solutions when the non-dimensional Planck's constant, $\varepsilon$, is small, but also on constructing an operator that maps initial values to solutions for the Schrödinger equation with multiscale properties. Using Gaussian wave packets framework, we first reformulate the Schrödinger equation as a system of ordinary differential equations. For a single initial condition, we solve the resulting system using PINNs or MscaleDNNs. Numerical simulations indicate that MscaleDNNs outperform PINNs, improving accuracy by one to two orders of magnitude. When dealing with a set of initial conditions, we adopt an operator-learning approach, such as physics-informed DeepONets. Numerical examples validate the effectiveness of physics-informed DeepONets with Gaussian wave packets in accurately mapping initial conditions to solutions.
format Preprint
id arxiv_https___arxiv_org_abs_2509_04453
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle Deep learning for the semi-classical limit of the Schrödinger equation
Huang, Jizu
You, Rukang
Zhou, Tao
Computational Physics
In this paper, we integrate neural networks and Gaussian wave packets to numerically solve the Schrödinger equation with a smooth potential near the semi-classical limit. Our focus is not only on accurately obtaining solutions when the non-dimensional Planck's constant, $\varepsilon$, is small, but also on constructing an operator that maps initial values to solutions for the Schrödinger equation with multiscale properties. Using Gaussian wave packets framework, we first reformulate the Schrödinger equation as a system of ordinary differential equations. For a single initial condition, we solve the resulting system using PINNs or MscaleDNNs. Numerical simulations indicate that MscaleDNNs outperform PINNs, improving accuracy by one to two orders of magnitude. When dealing with a set of initial conditions, we adopt an operator-learning approach, such as physics-informed DeepONets. Numerical examples validate the effectiveness of physics-informed DeepONets with Gaussian wave packets in accurately mapping initial conditions to solutions.
title Deep learning for the semi-classical limit of the Schrödinger equation
topic Computational Physics
url https://arxiv.org/abs/2509.04453