Ab-Initio- und semiempirische LCAO-MO-Berechnungen mit Berücksichtigung der Elektronenkorrelation zum Energieprofil der H-Verschiebung im Ethylkation
Author:
Publisher
Wiley
Subject
General Chemistry
Link
http://onlinelibrary.wiley.com/wol1/doi/10.1002/zfch.19770170214/fullpdf
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5. PNO–CI Studies of electron correlation effects. I. Configuration expansion by means of nonorthogonal orbitals, and application to the ground state and ionized states of methane
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1. Exploring the potential energy surface of the ethyl cation by new procedures;Journal of Molecular Structure: THEOCHEM;2002-05
2. The muonium bond;Chemical Physics Letters;1987-12
3. Solvent intervention in nucleophile-electrophile combination reactions;Journal of Molecular Structure: THEOCHEM;1985-02
4. Theoretische Untersuchungen zum elektrophilen Angriff. IX. Intramolekulare H-Verschiebungen in den protonierten orthodisubstituierten Aromaten o-Xylen und 1, 2-Difluorbenzen;Journal f�r Praktische Chemie;1983
5. Theoretical studies of the structure and stability of protonated olefins in the gas phase and in solution;Theoretica Chimica Acta;1980
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