Blue TADF Material Molecular Design for High Efficiency OLEDs

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Solution Overview

Problem

Current organic light-emitting diode (OLED) technologies face limitations with fluorescent materials having low luminous efficiency and phosphorescent materials being costly and unstable, particularly for blue light emission, while thermally activated delayed fluorescence (TADF) materials lack high RISC rate constant and photoluminescence quantum yield suitable for blue OLEDs, restricting their mass production applications.

Innovation Solution

A blue thermally activated delayed fluorescence material with a specific structural formula is synthesized via a Buchwald-Hartwig coupling reaction using palladium catalysts, achieving high luminous efficiency and long service life by optimizing the molecular structure and reaction conditions to enhance electron acceptor units' electron acceptance abilities.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Duration of action of stationary object

If fluorescent materials are used in OLEDs, then service life is extended, but luminous efficiency remains low due to 25% internal quantum efficiency limit

Engineering Contradiction:
Improveservice lifeVSAvoidluminous efficiency
Core Design Contradiction:
Duration of action of stationary objectVSUse of energy by moving object

Solution Approach 1:

The patent changes the energy level parameters of the material by designing specific molecular structures with different HOMO-LUMO gaps and singlet-triplet energy differences. This allows the material to achieve both long service life and high luminous efficiency by optimizing the energy level structure for TADF mechanism

Inventive Principle:
Principle #35Parameter changes

Solution Approach 2:

The patent creates composite molecular structures combining electron-donating groups and electron-accepting groups to form TADF materials that integrate the stability of fluorescent materials with the high efficiency characteristics of phosphorescent materials

Inventive Principle:
Principle #40Composite materials

2Use of energy by moving object

If transition metal complex phosphorescent materials are used, then internal quantum efficiency reaches close to 100%, but material cost increases and service life decreases

Engineering Contradiction:
Improveinternal quantum efficiencyVSAvoidservice life
Core Design Contradiction:
Use of energy by moving objectVSDuration of action of stationary object

Solution Approach 1:

The patent replaces expensive noble metal complexes with organic TADF materials that do not require Ir or Pt doping. These organic materials are cheaper and can be synthesized more easily while achieving comparable or better performance with extended service life

Inventive Principle:
Principle #27Cheap short-living objects (Disposable)

Solution Approach 2:

The patent substitutes the phosphorescence mechanism (requiring heavy metal atoms for spin-orbit coupling) with a thermal activation mechanism that uses ambient heat to drive reverse intersystem crossing, eliminating the need for noble metals while maintaining high efficiency

Inventive Principle:
Principle #28Mechanics substitution (Replace mechanical system)

3Use of energy by moving object

If phosphorescent blue light materials are used, then high efficiency is achieved, but performance stability remains poor

Engineering Contradiction:
Improveluminous efficiencyVSAvoidperformance stability
Core Design Contradiction:
Use of energy by moving objectVSReliability

Solution Approach 1:

The patent introduces specific functional groups and molecular structures at local positions within the molecule to enhance stability. By optimizing local structural features such as rigidifying groups and protective substituents, the material achieves both high efficiency and improved performance stability

Inventive Principle:
Principle #3Local quality

4Ease of manufacture

If TADF materials are used, then cost decreases and efficiency increases, but RISC rate constant and photoluminescence quantum yield are insufficient for blue OLEDs

Engineering Contradiction:
Improvematerial costVSAvoidRISC rate constant
Core Design Contradiction:
Ease of manufactureVSProductivity

Solution Approach 1:

The patent optimizes the energy level parameters by adjusting molecular structure to achieve appropriate singlet-triplet energy difference and HOMO-LUMO gap. This structural optimization directly enhances the RISC rate constant and photoluminescence quantum yield, making the material suitable for blue OLED applications

Inventive Principle:
Principle #35Parameter changes

5Use of energy by moving object

If TADF materials with broad spectrum are used, then high efficiency is achieved, but mass production device structure applications are limited

Engineering Contradiction:
Improveluminous efficiencyVSAvoidmass production applicability
Core Design Contradiction:
Use of energy by moving objectVSEase of manufacture

Solution Approach 1:

The patent narrows the emission spectrum by optimizing molecular structure and energy level spacing. This structural optimization reduces the broad spectrum characteristic while maintaining high efficiency, thereby improving compatibility with mass production device structures

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 blue TADF material achieves high RISC rate constant and photoluminescence quantum yield, breaking the 25% internal quantum efficiency limit, offering stable and efficient blue light emission suitable for OLEDs, and is integrated into electrothermally activated delayed fluorescent devices for improved performance.

Implementation Method 1

a Buchwald-Hartwig coupling reaction between a raw material 1 and a raw material 2 performed under an effect of a palladium catalyst to obtain the blue thermally activated delayed fluorescence material

Methodology Applied
Scientific EffectCatalysis: Catalysis

Implementation Method 2

the molecule has a lower minimum singlet triplet energy level difference (LEST), which can convert triplet excitons into singlet exciton radiation to emit light by thermal excitation reverse intersystem crossing

Methodology Applied
Scientific EffectThermal excitation reverse intersystem crossing:

Implementation Method 3

TADF materials usually exhibit photochemical long-lived fluorescence (delayed fluorescence). Lifetime of delayed fluorescence can be on order of microseconds to milliseconds

Methodology Applied
Scientific EffectDelayed fluorescence: Fluorescence

Data Source

PatentUS11898074B2Blue thermally activated delayed fluorescence material, synthesis method thereof, and use thereof
Publication Date: 2024.02.13 WUHAN CHINA STAR OPTOELECTRONICS SEMICONDUCTOR DISPLAY TECHNOLOGY CO LTD
  • US11898074B2 patent drawing
  • US11898074B2 patent drawing
  • US11898074B2 patent drawing

AI summary

The present disclosure relates to the field of organic light-emitting materials, and more particularly, to a blue thermally activated delayed fluorescence material, a synthesis method thereof, and use thereof. The blue thermally activated delayed fluorescence material has a following structural formula:the present disclosure provides a novel blue thermally activated delayed fluorescence material which has a lower singlet triplet energy level difference, a high RISC rate constant (kRISC), and a high photoluminescence quantum yield (PLQY) by finely adjusting a structure of electron acceptor units, making them have different abilities to accept electrons, thereby realizing fine adjustment of spectrum in the deep blue range.