论文标题
功能张量网络求解多体schrödinger方程
Functional Tensor Network Solving Many-body Schrödinger Equation
论文作者
论文摘要
Schrödinger方程属于量子物理学中最基本的微分方程。但是,确切的解决方案极为罕见,许多分析方法仅适用于扰动较小或相关性较弱的情况。在连续的空间中求解多体schrödinger方程与存在强相关性的存在是一个非常重要且充满挑战的问题。在这项工作中,我们提出了函数张量网络(FTN)方法来解决多体schrödinger方程。提供正统的功能碱基,我们表示多体波功能的系数作为张量网络。可以通过张量收缩来计算可观察到的能量,例如能量。模拟基态将解决张量网络定义的最小化问题。提出了基于自动微分张量的有效梯度定位算法。我们在这里以矩阵产品状态(MP)为例,其复杂性仅与系统大小线性缩放。我们采用我们的方法来解决耦合的谐波振荡器的基态,并通过与精确的溶液进行比较来实现高精度。还存在三体相互作用的可靠结果,其中系统不能将系统解耦到孤立的振荡器。我们的方法很简单,并且具有良好的控制误差,优于高度非固定的神经网络解决器。我们的工作将张量网络的应用从量子晶格模型扩展到连续空间中的系统。 FTN可以用作具有许多变量的微分方程的一般求解器。这里被说明的MP可以推广到例如费米子张量网络,以求解电子Schrödinger方程。
Schrödinger equation belongs to the most fundamental differential equations in quantum physics. However, the exact solutions are extremely rare, and many analytical methods are applicable only to the cases with small perturbations or weak correlations. Solving the many-body Schrödinger equation in the continuous spaces with the presence of strong correlations is an extremely important and challenging issue. In this work, we propose the functional tensor network (FTN) approach to solve the many-body Schrödinger equation. Provided the orthonormal functional bases, we represent the coefficients of the many-body wave-function as tensor network. The observables, such as energy, can be calculated simply by tensor contractions. Simulating the ground state becomes solving a minimization problem defined by the tensor network. An efficient gradient-decent algorithm based on the automatically differentiable tensors is proposed. We here take matrix product state (MPS) as an example, whose complexity scales only linearly with the system size. We apply our approach to solve the ground state of coupled harmonic oscillators, and achieve high accuracy by comparing with the exact solutions. Reliable results are also given with the presence of three-body interactions, where the system cannot be decoupled to isolated oscillators. Our approach is simple and with well-controlled error, superior to the highly-nonlinear neural-network solvers. Our work extends the applications of tensor network from quantum lattice models to the systems in the continuous space. FTN can be used as a general solver of the differential equations with many variables. The MPS exemplified here can be generalized to, e.g., the fermionic tensor networks, to solve the electronic Schrödinger equation.