Rotational States of the Hydrogen Molecule in the Crystalline Silicon Matrix
作者： V. V. Melnikov , S. N. Yurchenko
DOI: 10.1007/S11182-014-0187-9
关键词: Molecule 、 Electronic structure 、 Potential energy 、 Crystalline silicon 、 Spectral line 、 Molecular physics 、 Crystal 、 Raman spectroscopy 、 Materials science 、 Hydrogen
摘要: Results of a theoretical study the atomic and electronic structure hydrogen molecule in crystalline silicon matrix are presented. An analytical expression for rotational potential energy function interstitial crystal at tetrahedral position is derived. The terms corresponding wavefunctions as well ortho-para splitting Raman spectral lines calculated. It shown that states with l < 2 can be treated within framework free approach; however, noticeable ≥ indicates substantial influence semiconductor on properties system.
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