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Atom economy. Atom economy (atom efficiency/percentage) is the conversion efficiency of a chemical process in terms of all atoms involved and the desired products produced. The simplest definition was introduced by Barry Trost in 1991 and is equal to the ratio between the mass of desired product to the total mass of reactants, expressed as a percentage.
As only R is the useful product, the atoms of X, Y and Z are said to be wasted as by-products. Economic and environmental costs of disposal of these waste make a reaction with low atom economy to be "less green". A further simplified version of this is the carbon economy. It is how much carbon ends up in the useful product compared to how much ...
The model is very suitable for graphical presentation of the data and is therefore easy to use in practice." Free web based applications include Entall [6] and Miedema Calculator. [7] The latter was reviewed and improved in 2016, with an extension of the method. [8] [9] The original Algol program [10] was ported to Fortran. [11]
At 298 K, a reaction with ΔG ‡ = 23 kcal/mol has a rate constant of k ≈ 8.4 × 10 −5 s −1 and a half life of t 1/2 ≈ 2.3 hours, figures that are often rounded to k ~ 10 −4 s −1 and t 1/2 ~ 2 h. Thus, a free energy of activation of this magnitude corresponds to a typical reaction that proceeds to completion overnight at room ...
Hume-Rothery rules, named after William Hume-Rothery, are a set of basic rules that describe the conditions under which an element could dissolve in a metal, forming a solid solution. There are two sets of rules; one refers to substitutional solid solutions, and the other refers to interstitial solid solutions.
The reaction order is 1 with respect to B and −1 with respect to A. Reactant A inhibits the reaction at all concentrations. The following reactions follow a Langmuir–Hinshelwood mechanism: [4] 2 CO + O 2 → 2 CO 2 on a platinum catalyst. CO + 2H 2 → CH 3 OH on a ZnO catalyst. C 2 H 4 + H 2 → C 2 H 6 on a copper catalyst. N 2 O + H 2 ...
According to the model, adsorption and desorption are reversible processes. This model even explains the effect of pressure; i.e., at these conditions the adsorbate's partial pressure is related to its volume V adsorbed onto a solid adsorbent. The adsorbent, as indicated in the figure, is assumed to be an ideal solid surface composed of a ...
The laminar finite rate model computes the chemical source terms using the Arrhenius expressions and ignores turbulence fluctuations. This model provides with the exact solution for laminar flames but gives inaccurate solution for turbulent flames, in which turbulence highly affects the chemistry reaction rates, due to highly non-linear Arrhenius chemical kinetics.