Abstract

Variational perturbation theory was used to solve the Schrödinger equation for a hydrogen atom confined at the center of an impenetrable cavity. Ground state and excited state energies and expectation values calculated from the perturbation wavefunction are comparable in accuracy to results from direct numerical solution.

Highlights

  • Confined quantum mechanical systems are a useful model for simulating the effect of external conditions on an enclosed atom

  • Application of Rayleigh-Schrödinger perturbation theory to confined systems is complicated by the lack of closed form zero-order wavefunctions

  • When a zero-order wavefunction can be obtained, variational perturbation theory provides a method to carry the calculation to high order

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Summary

Introduction

Confined quantum mechanical systems are a useful model for simulating the effect of external conditions on an enclosed atom. Application of Rayleigh-Schrödinger perturbation theory to confined systems is complicated by the lack of closed form zero-order wavefunctions. When a zero-order wavefunction can be obtained, variational perturbation theory provides a method to carry the calculation to high order.

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