Origins of optical absorption characteristics of Cu2+complexes in aqueous solutions

Author:

Qiu S. Roger123,Wood Brandon C.123,Ehrmann Paul R.123,Demos Stavros G.123,Miller Philip E.123,Schaffers Kathleen I.123,Suratwala Tayyab I.123,Brow Richard K.4563

Affiliation:

1. Lawrence Livermore National Laboratory

2. Livermore

3. USA

4. Materials Science & Engineering

5. Missouri University of Science and Technology

6. Rolla

Abstract

Spectrometry is combined with first-principles simulations of solvated Cu2+complexes to elucidate the roles of ligand coordination, d-orbital fine structure, complex geometry, and solvation environment in determining optical absorption profiles.

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Reference46 articles.

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2. B. N. Figgis and M. A.Hitchman, Ligand field theory and its applications, Wiley-VCH, 2000

3. Spectral Characterization and Biological Studies on Mixed Ligand Complexes of Cr(III), Ni(II) and Cu(II) Derived from 3-Aminopyridine and Nitrite Ion

4. B. E. Douglas , D. H.McDaniel and J. J.Alexander, Concepts and Models of Inorganic Chemistry, Wiley, New York, 3rd edn, 1994

5. Copper(II) chromosomes and the rule of average environment

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