Concepedia

First principles study of the adsorption of hydrated heavy metals on graphene quantum dots

Hazem Abdelsalam, Nahed H. Teleb, I.S. Yahia, H. Y. Zahran, Hanan Elhaes, Medhat Ibrahim

Journal of Physics and Chemistry of Solids · 2019 · 83 citations · 47 references

DOI

Concepts

References

47

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

Self-Consistent Equations Including Exchange and Correlation Effects

W. Kohn, L. J. Sham · Physical Review · 1965 · 63.2K citations · Full text

, , +15

Bonded-atom fragments for describing molecular charge densities

F. L. Hirshfeld · Theoretical Chemistry Accounts · 1977 · 6.9K citations

, , +14

Basis Set Exchange:  A Community Database for Computational Sciences

Karen Schuchardt, Brett Didier, Todd Elsethagen et al. · Journal of Chemical Information and Modeling · 2007 · 3.1K citations

, , +7

Unimpeded Permeation of Water Through Helium-Leak–Tight Graphene-Based Membranes

Rahul R. Nair, HengAn Wu, P. N. Jayaram et al. · Science · 2012 · 3.1K citations · Full text

, , +17