INTEGRAL EQUATION FOR NUMERICAL SOLUTION OF STATIONARY QUANTUM-MECHANICAL PROBLEMS
Abstract and keywords
Abstract (English):
The work objective is to describe the numerical solution method for the stationary Schrödinger equation based on the application of the integral equation identical to the Schrödinger equation. The structure of this integral equation is close to the structure of the Fredholm equation of second kind and allows obtaining the problem numerical solution. The method under study allows finding the energy eigenvalues and eigensolutions to the quantum-mechanical problems of various dimensions. The test results of the solving problems method for one-dimensional and two-dimensional quantum oscillators are obtained. The found numerical values of eigenenergy and eigenfunctions of the oscillator are compared to the known analytical solutions, and then the error of result is evaluated. The highest accuracy of the solution is obtained for the first energy levels. The numerical solution error increases with the number of the energy eigenvalue. For the subsequent energy level, the error increases almost by an order of magnitude. The solution error for the fourth energy level is less than 2% if the integration domain contains 500 elements. If the energy level is degenerate, it is possible to obtain all eigenfunctions corresponding to the given level. For this purpose, various auxiliary functions the symmetry of which is coherent with the eigenfunction symmetry are used.

Keywords:
Schrödinger equation, eigenvalues, eigenfunctions, numerical solution, the fundamental solutions.
Text

Фундаментальное значение при решении квантовых механических задач описывается уравнением Шредингера [1]. Аналитические решения этого уравнения могут быть получены лишь для весьма ограниченного круга задач, преимущественно одномерных. Поэтому разработано множество приближенных методов решения уравнения Шредингера, как аналитических, с использованием теории возмущения [2–4], так и прямых численных методов. Несмотря на широкий спектр имеющихся численных методов решения уравнения Шредингера, таких, например, как метод Нумерова [5], метод диагонализации [6–7], спектральный метод [7], и других численных методов [8–12], проблема эффективных способов нахождения собственных энергий и собственных функций для основного уравнения квантовой механики, особенно при решении многомерных задач, продолжает оставаться актуальной. Ниже предложена методика решения уравнения Шредингера, основанная на приведении его к интегральному уравнению с последующим численным решением.

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