Concepedia

Assessment of quantum chemical methods and basis sets for excitation energy transfer

Reinhold F. Fink, Johannes Pfister, Hong Zhao, Bernd Engels

Chemical Physics · 2008 · 75 citations · 64 references

DOI

Concepts

References

64

Density-functional thermochemistry. III. The role of exact exchange

Axel D. Becke · The Journal of Chemical Physics · 1993 · 102.8K citations

, , +13

Gaussian basis sets for use in correlated molecular calculations. I. The atoms boron through neon and hydrogen

Thom H. Dunning · The Journal of Chemical Physics · 1989 · 31.7K citations

, , +17

The influence of polarization functions on molecular orbital hydrogenation energies

P. C. Hariharan, John A. Pople · Theoretical Chemistry Accounts · 1973 · 15.7K citations

, , +14

Electron affinities of the first-row atoms revisited. Systematic basis sets and wave functions

Rick A. Kendall, Thom H. Dunning, Robert J. Harrison · The Journal of Chemical Physics · 1992 · 15.5K citations

, , +17

Polymer Photovoltaic Cells: Enhanced Efficiencies via a Network of Internal Donor-Acceptor Heterojunctions

Gang Yu, Jun Gao, Jan C. Hummelen et al. · Science · 1995 · 10.3K citations · Full text

, , +17