Matrix elements of z/r3 and (3z2-r 2)/r5 in a slater basis for linear systems
- A.D. McLean
- M. Yoshimine
- 2004
- The Journal of Chemical Physics
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88 results for A.D. Mclean
Higher polarizabilities of linear molecules
- A.D. McLean
- M. Yoshimine
- 2004
- The Journal of Chemical Physics
Band strengths for electric dipole transitions from ab initio computation: Lio [formula omitted] AlO [formula omitted]
- M. Yoshimine
- A.D. McLean
- et al.
- 2003
- Journal of Chemical Physics
Use of nonrelativistic wavefunctions for the prediction of properties of molecules containing atoms of high Z. PbO as a test case
- Gretchen M. Schwenzer
- Dean H. Liskow
- et al.
- 2003
- The Journal of Chemical Physics
Theoretical Investigations of Terminal Alkenes as Putative Suicide Substrates of Cytochrome P-450
- Brian T. Luke
- Jack R. Collins
- et al.
- 2002
- JACS
A theoretical investigation of atmospheric sulfur chemistry. 1. The HSO/HOS energy separation and the heat of formation of HSO, HOS, and HS2
- Brian T. Luke
- A.D. McLean
- 2002
- Journal of Physical Chemistry
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.
- 2002
- Journal of Physical Chemistry
Carbanion Spectroscopy: CH2CN-
- Sean Moran
- H. Benton Ellis
- et al.
- 2002
- JACS
Rotational and vibrational spectra of ethynol from quantum-mechanical calculations
- D.J. DeFrees
- A.D. McLean
- 2002
- Journal of Physical Chemistry
Electron Correlation and Basis Set Effects on the Relative Stabilities of Classical and Nonclassical Structures of the 2-Norbornyl Cation
- M. Yoshimine
- A.D. McLean
- et al.
- 2002
- JACS