Barak Haim, Kay Kenneth G
Department of Chemistry, Bar-Ilan University, Ramat-Gan 52900, Israel.
Phys Rev E Stat Nonlin Soft Matter Phys. 2013 Dec;88(6):062926. doi: 10.1103/PhysRevE.88.062926. Epub 2013 Dec 27.
The ability of semiclassical initial-value representation (IVR) methods to determine approximate energy levels for bound systems is limited due to problems associated with long classical trajectories. These difficulties become especially severe for large or classically chaotic systems. This work attempts to overcome such problems by developing an IVR expression that is classically equivalent to Bogomolny's formula for the transfer matrix [E. B. Bogomolny, Nonlinearity 5, 805 (1992); Chaos 2, 5 (1992)] and can be used to determine semiclassical energy levels. The method is adapted to levels associated with states of desired symmetries and applied to two two-dimensional quartic oscillator systems, one integrable and one mostly chaotic. For both cases, the technique is found to resolve all energy levels in the ranges investigated. The IVR method does not require a search for special trajectories obeying boundary conditions on the Poincaré surface of section and leads to more rapid convergence of Monte Carlo phase space integrations than a previously developed IVR technique. It is found that semiclassical energies can be extracted from the eigenvalues of transfer matrices of dimension close to the theoretical minimum determined by Bogomolny's theory. The results support the assertion that the present IVR theory provides a different semiclassical approximation to the transfer matrix than that of Bogomolny for ℏ≠0. For the chaotic system investigated the IVR energies are found to be generally more accurate than those predicted by Bogomolny's theory.
由于与长经典轨迹相关的问题,半经典初值表示(IVR)方法确定束缚系统近似能级的能力受到限制。对于大型或经典混沌系统,这些困难变得尤为严重。这项工作试图通过开发一种IVR表达式来克服这些问题,该表达式在经典上等同于用于转移矩阵的博戈莫尔尼公式[E. B. 博戈莫尔尼,《非线性》5, 805 (1992); 《混沌》2, 5 (1992)],并可用于确定半经典能级。该方法适用于与所需对称性状态相关的能级,并应用于两个二维四次方振子系统,一个是可积的,一个主要是混沌的。对于这两种情况,该技术都能解析所研究范围内的所有能级。IVR方法不需要寻找在庞加莱截面表面上满足边界条件的特殊轨迹,并且与先前开发的IVR技术相比,能使蒙特卡罗相空间积分更快地收敛。研究发现,可以从维度接近博戈莫尔尼理论确定的理论最小值的转移矩阵的特征值中提取半经典能量。结果支持这样的断言,即对于ħ≠0,当前的IVR理论为转移矩阵提供了一种与博戈莫尔尼不同的半经典近似。对于所研究的混沌系统,发现IVR能量通常比博戈莫尔尼理论预测的更准确。