Concepedia

Methane partial oxidation in iron zeolites: theory versus experiment

Peter‐Paul Knops‐Gerrits, W.A. Goddard

Journal of Molecular Catalysis A Chemical · 2001 · 62 citations · 22 references

DOI

Concepts

References

22

UFF, a full periodic table force field for molecular mechanics and molecular dynamics simulations

Anthony K. Rappé, C. J. Casewit, K. S. Colwell et al. · Journal of the American Chemical Society · 1992 · 10.4K citations

, , +14

Charge equilibration for molecular dynamics simulations

Anthony K. Rappé, William A. Goddard · The Journal of Physical Chemistry · 1991 · 3.4K citations

, , +10

Synthesis of ethylene and ethane by partial oxidation of methane over lithium-doped magnesium oxide

Tomoyasu Ito, Jack H. Lunsford · Nature · 1985 · 573 citations

, , +6

Generation of active oxygen species on solid surfaces. Opportunity for novel oxidation technologies over zeolites

G.I. Panov, Mikhail A. Rodkin · Catalysis Today · 1998 · 483 citations

, , +16

The role of iron in N2O decomposition on ZSM-5 zeolite and reactivity of the surface oxygen formed

G.I. Pannov, A. S. Kharitonov · Journal of Molecular Catalysis · 1990 · 348 citations

, , +16