LiCoPO4 Cathode Doping for Capacity Fade Reduction

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Solution Overview

Problem

Current LiCoPO4-based lithium-ion positive electrode materials exhibit high capacity fade, limiting their discharge capacity and cycle life, despite initial improvements in rate of discharge.

Innovation Solution

A novel Li-ion positive electrode material with a nominal stoichiometry of Li1+y/2 Co1-x-y-z-d Si z Fe x M y M' d (PO4)1+y/2, where M is a trivalent cation and M' is a divalent cation, with specific compositional ranges for y, x, z, and d, which includes Si to enhance coulombic efficiency and cycle life, is developed.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Use of energy by moving object

If LiCoPO4 is used as the positive electrode material to increase energy density, then the stored energy increases, but capacity fade increases significantly

Engineering Contradiction:
Improvestored energyVSAvoidcapacity fade
Core Design Contradiction:
Use of energy by moving objectVSReliability

Solution Approach 1:

The patent modifies the stoichiometric parameters of LiCoPO4 by introducing non-stoichiometric composition (Li1+y/2Co1-x-y-z-dSizFexM yM'd(PO4)1+y/2) and doping with multiple elements (Si, Fe, Cr, Ti, Al, Ga) to change the electronic and structural parameters, thereby reducing capacity fade while maintaining high energy density

Inventive Principle:
Principle #35Parameter changes

Solution Approach 2:

The patent creates a composite material system by combining LiCoPO4 with multiple dopant elements (Si, Fe, Cr, Ti, Al, Ga) in specific ratios, forming a multi-element doped phospho-olivine structure that synergistically improves both energy density and cycle stability

Inventive Principle:
Principle #40Composite materials

2Power

If LiCoPO4 is used to achieve high voltage operation, then the discharge voltage increases, but discharge capacity retention decreases

Engineering Contradiction:
Improvedischarge voltageVSAvoiddischarge capacity retention
Core Design Contradiction:
PowerVSDuration of action of moving object

Solution Approach 1:

The patent changes the chemical composition parameters by introducing multiple dopants in controlled amounts, which modifies the electronic structure and electrochemical properties to maintain high voltage while improving capacity retention over cycles

Inventive Principle:
Principle #35Parameter changes

Solution Approach 2:

The patent introduces localized doping elements at specific sites within the LiCoPO4 structure, where Si, Fe, Cr, Ti, Al, or Ga atoms substitute for Co atoms at specific lattice positions, creating local structural modifications that enhance overall discharge capacity retention while preserving high voltage characteristics

Inventive Principle:
Principle #3Local quality

3Duration of action of stationary object

If Fe substitution is increased to reduce capacity fade, then cycle life improves, but initial discharge capacity increases less

Engineering Contradiction:
Improvecycle lifeVSAvoidinitial discharge capacity
Core Design Contradiction:
Duration of action of stationary objectVSProductivity

Solution Approach 1:

The patent employs a composite doping strategy combining Fe with other elements (Si, Cr, Ti, Al, or Ga) where each element contributes different beneficial properties, achieving both long cycle life and high initial discharge capacity through synergistic effects rather than relying on Fe substitution alone

Inventive Principle:
Principle #40Composite materials

Solution Approach 2:

The patent optimizes the concentration parameters of multiple dopants simultaneously (x for Fe, y for M, z for Si, d for M') to achieve the optimal balance between cycle life and initial discharge capacity, rather than maximizing a single dopant concentration

Inventive Principle:
Principle #35Parameter changes

Data Source

PatentEP3291342B1High voltage lithium ion positive electrode material
Publication Date: 2019.07.03 UNITED STATES OF AMERICA THE AS REPRESENTED BY THE SEC OF THE ARMY
  • EP3291342B1 patent drawingFigure 1
  • EP3291342B1 patent drawingFigure 2
  • EP3291342B1 patent drawingFigure 3

AI summary

A positive electrode material having a nominal stoichiometry Li1+y/2Co1-x-y-z-dSizFexMyM'd(PO4)1+y/2 where M is a trivalent cation selected from at least one of Cr, Ti, Al, Mn, Ni, V, Sc, La and/or Ga, M' is a divalent cation selected from at least one of Mn, Ni, Zn, Sr, Cu, Ca and/or Mg, y is within a range of 0 < y ≤ 0.10 and x is within a range of 0 ≤ x ≤ 0.2. The use of double compositional modification to LiCoPO4 increases the discharge capacity from ~100 mAh/g to about 130 mAh/g while retaining the discharge capacity retention of the singly Fesubstituted LiCoPO4. Additional compositional modification to include Si increases the cycle life and greatly improved the coulombic efficiency to between 97-100% at a C/3 cycle rate.