Concepedia

Experimental and DFT studies on the vibrational and electronic spectra of 2-(1H-Imidazo [4,5-ƒ][1,10]phenanthrolin-2-yl)phenol

Tingting Tang, Guodong Tang, Shanshan Kou, Jianyin Zhao, Lance F. Culnane, Yu Zhang

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2013 · 16 citations · 25 references

DOI

Concepts

References

25

Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density

Chengteh Lee, Weitao Yang, Robert G. Parr · Physical review. B, Condensed matter · 1988 · 100.1K citations

, , +17

Density-functional exchange-energy approximation with correct asymptotic behavior

Axel D. Becke · Physical review. A, General physics · 1988 · 53.5K citations

, , +17

Remarks on the use of the apparent surface charges (ASC) methods in solvation problems: Iterative versus matrix‐inversion procedures and the renormalization of the apparent charges

Roberto Cammi, J. Tomasi · Journal of Computational Chemistry · 1995 · 1.4K citations

, , +12

Dynamic polarizabilities and excitation spectra from a molecular implementation of time-dependent density-functional response theory: N2 as a case study

Christine Jamorski, Mark E. Casida, Dennis R. Salahub · The Journal of Chemical Physics · 1996 · 917 citations

, , +17

Areneruthenium complexes as anticancer agents

Georg Süß‐Fink · Dalton Transactions · 2009 · 635 citations

, , +16