UV-Vis Concentration Analysis for Overlapping Transition Metal Spectra

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Solution Overview

Problem

Current methods fail to accurately determine the concentrations of multiple transition metal compounds in solutions, especially when their UV-Vis spectra overlap or when one compound is in large excess, hindering real-time monitoring and control in polymerization processes.

Innovation Solution

A method using UV-Vis spectroscopy involves providing reference absorbance profiles for each transition metal compound, submitting a sample to a chamber, irradiating it with UV-visible light, and calculating a curve to fit the sample absorbance profile, allowing for precise determination of concentrations through least-squares regression, even in overlapping spectra or excess conditions.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Productivity

If UV-Vis spectroscopy is used to determine concentrations of multiple transition metal compounds, then real-time monitoring capability is improved, but measurement precision deteriorates when spectra overlap or one compound is in large excess

Engineering Contradiction:
Improvereal-time monitoring capabilityVSAvoidconcentration determination accuracy
Core Design Contradiction:
ProductivityVSMeasurement precision

Solution Approach 1:

The patent segments the overlapping absorption spectrum into multiple discrete wavelength measurements. By measuring absorbance at several specific wavelengths and solving a system of linear equations, the method resolves individual compound concentrations even when their spectra overlap, thereby maintaining measurement precision while enabling real-time monitoring.

Inventive Principle:
Principle #1Segmentation

Solution Approach 2:

The patent changes the measurement parameters by selecting specific wavelengths where the transition metal compounds have distinct absorbance characteristics. By optimizing the wavelength selection and using multiple wavelengths simultaneously, the method distinguishes between compounds with overlapping spectra and accurately determines their concentrations in real-time.

Inventive Principle:
Principle #35Parameter changes

2Device complexity

If conventional UV-Vis spectroscopy is used, then device complexity is reduced, but the ability to handle overlapping spectra and excess conditions deteriorates

Engineering Contradiction:
Improvespectroscopy system simplicityVSAvoidhandling of overlapping spectra and excess conditions
Core Design Contradiction:
Device complexityVSAdaptability or versatility

Solution Approach 1:

The patent makes the UV-Vis spectroscopy system universal by developing a mathematical approach that handles multiple scenarios: compounds with non-overlapping spectra, overlapping spectra, and cases where one compound is in large excess. The same multi-wavelength measurement and equation-solving methodology applies to all these cases, enhancing the system's versatility without increasing device complexity.

Inventive Principle:
Principle #6Universality (Multi-functionality)

3Ease of operation

If simple UV-Vis absorbance measurement is used, then ease of operation is improved, but measurement precision deteriorates in complex multicomponent solutions

Engineering Contradiction:
Improvesimplicity of measurement procedureVSAvoidconcentration accuracy in multicomponent solutions
Core Design Contradiction:
Ease of operationVSMeasurement precision

Solution Approach 1:

The patent implements a self-service approach where the system automatically performs multi-wavelength absorbance measurements and solves the system of equations to determine individual compound concentrations. The instrument itself handles the complexity of data processing and calculation, maintaining ease of operation while achieving high measurement precision in multicomponent solutions.

Inventive Principle:
Principle #25Self-service

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

Enables precise, real-time monitoring and control of transition metal compound concentrations in polymerization processes, improving the quality and consistency of polymer products by accurately determining individual concentrations even in complex solutions.

Implementation Method 1

irradiating the sample in the chamber with a light beam at a wavelength in the UV-visible spectrum, generating a sample absorbance profile of the sample

Methodology Applied
Scientific EffectAbsorption spectroscopy: Absorption Spectroscopy

Data Source

PatentUS11170874B2Methods for determining transition metal compound concentrations in multicomponent liquid systems
Publication Date: 2021.11.09 CHEVRON PHILLIPS CHEMICAL COMPANY LP
  • US11170874B2 patent drawing
  • US11170874B2 patent drawing
  • US11170874B2 patent drawing

AI summary

Methods for simultaneously determining the concentrations of transition metal compounds in solutions containing two or more transition metal compounds are described. Polymerization reactor systems providing real-time monitoring and control of the concentrations of the transition metal components of a multicomponent catalyst system are disclosed, as well as methods for operating such polymerization reactor systems, and for improving methods of preparing the multicomponent catalyst system.