A theoretical investigation of the groun
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D.T. Clark; A. Harrision
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Article
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1981
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Elsevier Science
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English
β 398 KB
Non-empirical LCAO MO SCF computations have been carried out on the ground and core-hole states of various structures for the 2-butyl cation. The enhancement of weak interactions on going to the core-hole state manifold potentially provides a straightforward means of distinguishing between isomeric