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Hydrogen molecular ion and molecule in two dimensions

机译:氢分子离子和二维分子

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摘要

We discuss some general properties of the wave functions of H_2~+ in two dimension, when the electron is close to the nucles, and when it is far away from the nucles. Based on these properties, some simple, parameter-free wave functions are developed for some of the states. They lead to quite accurate energies and give an insight into the structure of H_2~+ in two dimensions. These wave functions and appropriate correlation functions, are then used to develop reliable wave functions for H_2 in two dimensions. They provide a clear and interesting comparison with the corresponding results in three dimensions.
机译:当电子靠近原子核,而远离原子核时,我们将在二维上讨论H_2〜+的波函数的一些一般性质。基于这些特性,为某些状态开发了一些简单的无参数波动函数。它们产生了相当精确的能量,并从二维角度洞察了H_2〜+的结构。然后,这些波函数和适当的相关函数将用于为二维H_2开发可靠的波函数。它们提供了与三个方面的相应结果的清晰有趣的比较。

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