QM evaluation of the intramolecular aromatic - interactions of Ir(I) complex transition states Academic Article

authors

• Hall, Michael

published proceedings

• JOURNAL OF MOLECULAR STRUCTURE

author list (cited authors)

• Liu, Y., Gallo, A. A., Liu, Y., Hall, M. B., & Johnson, B. R.

citation count

• 1

complete list of authors

• Liu, Yuemin||Gallo, August A||Liu, Yucheng||Hall, Michael B||Johnson, Bruce R

publication date

• November 2023

publisher

• Elsevier  Publisher

keywords

• Ccsd(t)
• DFT
• Intramolecular & Pi;-& Pi; Interaction
• Mp2
• Restricted Open Shell
• Unrestricted Open Shell

Digital Object Identifier (DOI)

• 10.1016/j.molstruc.2023.135907

start page

• 135907

end page

• 135907

volume

• 1291

URL

• http://dx.doi.org/10.1016/j.molstruc.2023.135907