Mechanochemical Synthesis of Stable Functionalized Nanoparticles

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Solution Overview

Problem

Current methods for producing silicon nanoparticles are complex, involve corrosive or toxic reagents, and are not practical for nanoparticles due to the need for ultrahigh vacuum conditions or multistep processes, which limits the production of stable, passivated silicon nanoparticles with quantum confinement effects.

Innovation Solution

A single-step mechanochemical process using high-energy ball milling in an inert atmosphere with a reactive medium such as alcohols or alkynes to form stable, functionalized silicon or germanium nanoparticles, creating covalent linkages and achieving direct surface passivation without unstable intermediates or toxic chemicals.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Ease of manufacture

If current methods for producing silicon nanoparticles are used, then nanoparticles can be formed, but the process is complex and involves corrosive or toxic reagents

Engineering Contradiction:
Improveease of manufactureVSAvoidprocess complexity
Core Design Contradiction:
Ease of manufactureVSDevice complexity

Solution Approach 1:

The patent combines nanoparticle formation and surface passivation into a single mechanochemical ball-milling step. The silicon particles are reduced to nanoparticle size and simultaneously functionalized with organic groups from the reactive medium, eliminating the need for separate synthesis and passivation steps that characterize conventional methods

Inventive Principle:
Principle #5Merging (Combining)

Solution Approach 2:

The reactive organic medium serves as an intermediary that facilitates both particle size reduction and surface functionalization. The organic molecules act as a mediator between the mechanical energy input and the chemical transformation of the silicon surface, enabling direct passivation during milling without requiring unstable intermediates or toxic reagents

Inventive Principle:
Principle #24Intermediary (Mediator)

2Reliability

If ultrahigh vacuum conditions or multistep processes are used, then stable passivated nanoparticles can be produced, but the process is not practical for production

Engineering Contradiction:
Improvestability of nanoparticlesVSAvoidpracticality for production
Core Design Contradiction:
ReliabilityVSEase of manufacture

Solution Approach 1:

The system performs self-service by using the reactive organic medium to automatically passivate the silicon particle surfaces as they are generated during ball milling. The freshly exposed silicon surfaces immediately react with the organic groups in the medium, providing inherent stability without requiring subsequent treatment steps or specialized vacuum conditions

Inventive Principle:
Principle #25Self-service

Solution Approach 2:

The patent changes the physical and chemical parameters of the processing environment from ultrahigh vacuum to ambient conditions with a reactive organic medium. This parameter change enables the process to be conducted in practical production settings while maintaining nanoparticle stability through chemical passivation

Inventive Principle:
Principle #35Parameter changes

3Manufacturing precision

If conventional synthesis methods are used, then silicon nanoparticles can be formed, but unstable intermediates or toxic chemicals are required

Engineering Contradiction:
Improvesurface passivation qualityVSAvoidtoxic reagents and unstable intermediates
Core Design Contradiction:
Manufacturing precisionVSObject-affected harmful factors

Solution Approach 1:

The patent converts the potentially harmful effect of highly reactive, unstable silicon surfaces into a benefit by immediately utilizing their reactivity to form strong covalent bonds with organic groups during ball milling. The instability that would normally require careful handling under vacuum is transformed into an opportunity for direct, stable functionalization with benign organic reagents

Inventive Principle:
Principle #22Blessing in disguise (Convert harm into benefit)

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

This method produces stable, functionalized nanoparticles with size-dependent quantum confinement effects, including photoluminescence, and is scalable, maintaining fluorescence over months with improved stability and solubility in organic and aqueous systems.

Implementation Method 1

repeatedly mechanically impacting the first material in the presence of the reactive medium by high energy ball milling under inert atmosphere, wherein the first material reacts with the reactive medium forming covalent linkages

Methodology Applied
Scientific EffectMechanochemical reaction:

Implementation Method 2

Quantum confinement occurs when electrons and holes in a semiconductor are restricted in one or more dimensions. Quantum confinement effects at very small crystalline sizes can cause silicon and germanium nanoparticles to fluoresce

Methodology Applied
Scientific EffectQuantum confinement:

Implementation Method 3

Photoluminescence is a process in which a chemical compound absorbs photons (electromagnetic radiation), thus transitioning to a higher electronic energy state, and then radiates photons back out, returning to a lower energy state

Methodology Applied
Scientific EffectPhotoluminescence: Photoluminescence

Data Source

PatentEP2162386B1Method of forming stable functionalized nanoparticles
Publication Date: 2020.03.18 THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND
  • EP2162386B1 patent drawingFigure 1
  • EP2162386B1 patent drawingFigure 2
  • EP2162386B1 patent drawingFigure 3

AI summary

A novel top-down procedure for synthesis of stable passivated nanoparticles uses a one-step mechanochemical process to form and passivate the nanoparticles. High-energy ball milling (HEBM) can advantageously be used to mechanically reduce the size of material to nanoparticles. When the reduction of size occurs in a reactive medium, the passivation of the nanoparticles occurs as the nanoparticles are formed. This results in stable passivated silicon nanoparticles. This procedure can be used, for example in the synthesis of stable alkyl- or alkenyl-passivated silicon and germanium nanoparticles. The covalent bonds between the silicon or germanium and the carbon in the reactive medium create very stable nanoparticles.