Concepedia

Studies on aliphatic polyesters. Part II. Ab initio, density functional and force field studies of model molecules with two carboxyl groups

J Blomqvist, B. Mannfors, Lars‐Olof Pietilä

Journal of Molecular Structure THEOCHEM · 2000 · 27 citations · 25 references

DOI

Concepts

References

25

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

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

, , +13

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

Density-functional theory of atoms and molecules

James D. Patterson · Annals of Nuclear Energy · 1989 · 12.6K citations

, , +12

Statistical mechanics of chain molecules

Paul J. Flory, M.V. Volkenstein · Biopolymers · 1969 · 6.5K citations

, , +14