Concepedia

Trifluoroacetaldehyde aminolysis catalyzed by a single water molecule: An important sink pathway for trifluoroacetaldehyde and a potential pathway for secondary organic aerosol growth

Z. DONG, F. Xu, Ellen Mitchell, Bo Long

Atmospheric Environment · 2021 · 18 citations · 61 references

DOI

Concepts

References

61

The M06 suite of density functionals for main group thermochemistry, thermochemical kinetics, noncovalent interactions, excited states, and transition elements: two new functionals and systematic testing of four M06-class functionals and 12 other functionals

Yan Zhao, Donald G. Truhlar · Theoretical Chemistry Accounts · 2007 · 29.2K citations · Full text

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The path of chemical reactions - the IRC approach

Kenichi Fukui · Accounts of Chemical Research · 1981 · 6.4K citations

, , +19

Evaluated kinetic and photochemical data for atmospheric chemistry: Volume II – gas phase reactions of organic species

Roger Atkinson, D. L. Baulch, R. A. Cox et al. · Atmospheric chemistry and physics · 2006 · 2.2K citations · Full text

, , +13

A simple and efficient CCSD(T)-F12 approximation

Thomas B. Adler, Gerald Knizia, Hans‐Joachim Werner · The Journal of Chemical Physics · 2007 · 2K citations

, , +18

Simplified CCSD(T)-F12 methods: Theory and benchmarks

Gerald Knizia, Thomas B. Adler, Hans‐Joachim Werner · The Journal of Chemical Physics · 2009 · 1.9K citations

, , +15