Science Fair Project Encyclopedia
Extended Huckel method
The extended Huckel method is a way of determining the structural geometry of an organic molecule. It involves calculations of the electronic interactions, and can determine the relative energy in a given geometrical configuration.
This in certain theoretical studies has been used as a prelimiinary (and usually fairly accurate) step to determining the structure and electronic properties using the CNDO/2 method. The latter method has been described as more accurate in its detemination.
平安人寿
10-26-2009 08:16:03
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The contents of this article is licensed from www.wikipedia.org under the GNU Free Documentation License. Click here to see the transparent copy and copyright details