Zeolite Functionalization with Phosphonic Acid Monolayers

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Solution Overview

Problem

Conventional separation technologies for light gases, such as alkene/alkane mixtures, are energy-intensive and inefficient, with existing zeolites lacking tunable pore diameters and chemistries to effectively separate molecules of similar sizes, particularly in propylene/propane and ethylene/ethane separations.

Innovation Solution

Functionalization of zeolites with self-assembled monolayers of phosphonic acids, specifically by mixing zeolites with phosphonic acid in an organic solvent, followed by stirring, centrifuging, washing, and solvent removal, to create a functionalized zeolite with enhanced adsorption selectivity and diffusion control.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Manufacturing precision

If conventional distillation is used to separate propylene/propane mixtures, then high-purity propylene can be obtained, but energy consumption increases significantly

Engineering Contradiction:
Improvepropylene purityVSAvoidenergy consumption
Core Design Contradiction:
Manufacturing precisionVSUse of energy by moving object

Solution Approach 1:

The patent uses zeolite 5A, a porous material with uniform pore sizes of 0.43 nm, to separate propylene and propane molecules. The porous structure allows selective adsorption of propylene over propane, enabling separation without energy-intensive distillation processes.

Inventive Principle:
Principle #31Porous materials

Solution Approach 2:

The patent creates a composite material by depositing titania-based molecular layer deposition (MLD) coating on zeolite 5A particles. This composite structure combines the selective adsorption properties of zeolite with the enhanced interaction properties of titania, increasing propylene/propane ideal adsorption selectivity from 1.2 to 6.0.

Inventive Principle:
Principle #40Composite materials

2Speed

If zeolite pore diameter is increased to accommodate larger molecules, then diffusion rate improves, but selectivity for separating similar-sized molecules decreases

Engineering Contradiction:
Improvediffusion rateVSAvoidseparation selectivity
Core Design Contradiction:
SpeedVSManufacturing precision

Solution Approach 1:

The patent modifies the local chemical environment within the zeolite pores by introducing titania-based MLD coating. This creates localized functional groups that specifically interact with propylene molecules, enhancing selectivity without changing the overall pore diameter of the zeolite structure.

Inventive Principle:
Principle #3Local quality

Solution Approach 2:

The patent changes the chemical composition parameters of the zeolite by depositing titania-based MLD coating, which introduces oxygen-containing functional groups. This chemical modification enhances the interaction with propylene molecules while maintaining the physical pore structure, achieving both good diffusion and selectivity.

Inventive Principle:
Principle #35Parameter changes

Applied Scientific Principles

This section explains which scientific principles are used to turn an abstract innovation direction into a practical engineering solution.

Function Achieved in This Case

The functionalized zeolites exhibit significantly improved propylene/propane, ethane/propane, and ethane/n-butane ideal adsorption selectivities, reducing energy requirements and enhancing separation efficiency by tuning the zeolite's surface and pore structure.

Implementation Method 1

functionalized the external surface of zeolites with an additional diffusion layer, e.g. by reacting the zeolite with silanes

Methodology Applied
Scientific EffectChemisorption: Chemisorption

Implementation Method 2

the self-assembly of the monolayer is spontaneous due to thermodynamically favorable van der Waals interactions between tail groups

Methodology Applied
Scientific EffectVan der Waals interactions: Van der Waals Force

Implementation Method 3

Application of nanoporous molecular sieves in moving bed or pressure swing adsorption systems has been found to have the potential to significantly decrease energy requirements for propane/propylene separation

Methodology Applied
Scientific EffectAdsorption: Adsorption

Data Source

PatentUS11918974B2Functionalization of zeolites
Publication Date: 2024.03.05 THE REGENTS OF THE UNIVERSITY OF COLORADO
  • US11918974B2 patent drawing
  • US11918974B2 patent drawing
  • US11918974B2 patent drawing

AI summary

Functionalized zeolites, including a zeolite substrate and a self-assembled monolayer of a phosphonic acid on a surface of the zeolite substrate, are disclosed, as are methods of making and using the functionalized zeolites. The disclosed methods and compositions have various applications, including in the use of molecular sieves to separate small-molecule gases from mixtures thereof. Gas adsorption selectivities and diffusion rates of the functionalized zeolites may be tuned or selected according to the disclosed methods.