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首页> 外文期刊>International Journal of Quantum Chemistry >ADDENDUM TO CONSTRUCTION OF LINEARLY INDEPENDENT RELATIVISTIC SYMMETRY ORBITALS FOR FINITE DOUBLE-POINT GROUPS INCLUDING TIME-REVERSAL SYMMETRY
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ADDENDUM TO CONSTRUCTION OF LINEARLY INDEPENDENT RELATIVISTIC SYMMETRY ORBITALS FOR FINITE DOUBLE-POINT GROUPS INCLUDING TIME-REVERSAL SYMMETRY

机译:包含时间逆对称的有限双点群的线性独立相对论对称轨道的构造

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摘要

In a previous article [J. Meyer, Int. J. Quantum Chem. 33, 445 (1988)], the formalism for the construction of linearly independent relativistic symmetry-adapted molecular basis functions under consideration of time-reversal symmetry was published. We present here an addition and correction of the application of time reversal on the construction. This new theory is now applicable to all double-point groups, including the icosahedral groups not considered so far. (C) 1997 John Wiley & Sons, Inc. [References: 5]
机译:在上一篇文章中[J.迈尔(Inte。) J.量子化学。 33,445(1988)],发表了在考虑时间-逆向对称性的情况下构造线性独立的相对论对称性分子基础函数的形式学。在这里,我们介绍了时间逆转在结构上的应用的补充和修正。现在,这种新理论适用于所有双点组,包括到目前为止尚未考虑的二十面体组。 (C)1997 John Wiley&Sons,Inc. [参考:5]

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