JACS
Paper
01 May 2002

Classical and Nonclassical Structures of the Vinyl Cation. An Accurate Computational Determination of their Relative Stabilities and Optimum Rearrangement Path

View publication

Abstract

No abstract available.

Related

Paper

Theoretical calculations and experimental studies on the electronic structures of hydrazones and hydrazone radical cations: Formaldehyde hydrazone and benzaldehyde diphenylhydrazones

J. Pacansky, A.D. McLean, et al.

Journal of Physical Chemistry

Paper

Theoretical investigation of the anaerobic reduction of halogenated alkanes by cytochrome P-450. 2. Vertical electron affinities of chlorofluoromethanes as a measure of their activity

Brian T. Luke, Gilda H. Loew, et al.

JACS

Paper

Symmetry breaking in molecular calculations and the reliable prediction of equilibrium geometries. The formyloxyl radical as an example

A.D. McLean, B.H. Lengsfield III, et al.

The Journal of Chemical Physics

Paper

Second row homopolar diatomic molecules. Potential curves, spectroscopic constants, and dissociation energies at the basis set limit for SCF and limited CI wave functions

A.D. McLean, B. Liu, et al.

The Journal of Chemical Physics

View all publications
  1. Home
  2. ↳ Publications

Date

01 May 2002

Publication

JACS

Authors

  • J. Weber
  • A.D. McLean
IBM-affiliated at time of publication

Resources

  • Publication

Share