arXivDaily arXiv每日学术速递 周一至周五更新
arXiv 1504.02891math.NAcs.NA

一种用于计算玻色-爱因斯坦凝聚态基态的正则牛顿方法

A Regularized Newton Method for Computing Ground States of Bose-Einstein condensates

Fudan University(复旦大学);Peking University(北京大学);National University of Singapore(新加坡国立大学)

Xinming Wu, Zaiwen Wen, Weizhu Bao

AI总结:

本文提出一种正则牛顿方法用于计算玻色-爱因斯坦凝聚态基态,通过有限差分、正弦或傅里叶伪谱离散化将能量泛函和约束离散化,结合可行梯度法和多级网格技术,实现高效准确的求解。

摘要:

本文提出了一种正则牛顿方法用于计算玻色-爱因斯坦凝聚态(BEC)的基态,该问题可表述为带有球形约束的能量最小化问题。能量泛函和约束通过有限差分、正弦或傅里叶伪谱离散化进行离散化,从而将原始无限维非凸最小化问题近似为有限维约束非凸最小化问题。首先通过可行梯度法构造初始解,该方法是显式方案且自动维持球形约束。为加速梯度法的收敛,我们在每次牛顿迭代中用正则化项近似能量泛函的二阶泰勒展开,并采用多级网格技术选择初始数据。这导致一个标准的信任区域子问题,再次通过可行梯度法求解。通过调整正则化参数作为标准信任区域策略,建立了正则牛顿方法的收敛性。对具有光学晶格势的三维BEC和快速旋转且强排斥相互作用的二维旋转BEC等具有挑战性的例子进行了大量数值实验,结果表明该方法高效、准确且稳健。

英文摘要:

In this paper, we propose a regularized Newton method for computing ground states of Bose-Einstein condensates (BECs), which can be formulated as an energy minimization problem with a spherical constraint. The energy functional and constraint are discretized by either the finite difference, or sine or Fourier pseudospectral discretization schemes and thus the original infinite dimensional nonconvex minimization problem is approximated by a finite dimensional constrained nonconvex minimization problem. Then an initial solution is first constructed by using a feasible gradient type method, which is an explicit scheme and maintains the spherical constraint automatically. To accelerate the convergence of the gradient type method, we approximate the energy functional by its second-order Taylor expansion with a regularized term at each Newton iteration and adopt a cascadic multigrid technique for selecting initial data. It leads to a standard trust-region subproblem and we solve it again by the feasible gradient type method. The convergence of the regularized Newton method is established by adjusting the regularization parameter as the standard trust-region strategy. Extensive numerical experiments on challenging examples, including a BEC in three dimensions with an optical lattice potential and rotating BECs in two dimensions with rapid rotation and strongly repulsive interaction, show that our method is efficient, accurate and robust.

机构、总结、中文摘要均由AI分析而来,可能存在错误,请以论文正文为准。

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