DOE PAGES title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Bayesian optimization of entropy-stabilized metal fluoride conversion cathodes and their synthesis

Journal Article · · Journal of Power Sources

Not Available

Sponsoring Organization:
USDOE
OSTI ID:
2519283
Journal Information:
Journal of Power Sources, Journal Name: Journal of Power Sources Journal Issue: C Vol. 635; ISSN 0378-7753
Publisher:
ElsevierCopyright Statement
Country of Publication:
Netherlands
Language:
English

References (36)

Halide‐Based Materials and Chemistry for Rechargeable Batteries journal January 2020
Bayesian Optimization of High‐Entropy Alloy Compositions for Electrocatalytic Oxygen Reduction** journal October 2021
Selection of Electrolyte Additive Quantities for Lithium‐Ion Batteries Using Bayesian Optimization journal March 2022
Revisiting the conversion reaction voltage and the reversibility of the CuF2 electrode in Li-ion batteries journal February 2017
Efficient stochastic generation of special quasirandom structures journal September 2013
Matminer: An open source toolkit for materials data mining journal September 2018
High entropy fluorides as conversion cathodes with tailorable electrochemical performance journal September 2022
High-entropy alloy: challenges and prospects journal July 2016
Accelerating materials discovery with Bayesian optimization and graph deep learning journal December 2021
Understanding Conversion-Type Electrodes for Lithium Rechargeable Batteries journal January 2018
Gaussian Process Regression for Materials and Molecules journal August 2021
Bayesian Machine Learning for Efficient Minimization of Defects in ALD Passivation Layers journal November 2021
Cu-Substituted NiF2 as a Cathode Material for Li-Ion Batteries journal December 2018
Exploring the Composition Space of High-Entropy Alloy Nanoparticles for the Electrocatalytic H2/CO Oxidation with Bayesian Optimization journal September 2022
Metal–Organic Framework-Derived Nanoconfinements of CoF2 and Mixed-Conducting Wiring for High-Performance Metal Fluoride-Lithium Battery journal December 2020
Initial Sample Selection in Bayesian Optimization for Combinatorial Optimization of Chemical Compounds journal December 2022
Conversion Reaction Mechanisms in Lithium Ion Batteries: Study of the Binary Metal Fluoride Electrodes journal November 2011
Comprehensive Study of the CuF 2 Conversion Reaction Mechanism in a Lithium Ion Battery journal July 2014
Ternary metal fluorides as high-energy cathodes with low cycling hysteresis journal March 2015
High entropy oxides for reversible energy storage journal August 2018
Bayesian optimization with active learning of design constraints using an entropy-based approach journal April 2023
Revisiting metal fluorides as lithium-ion battery cathodes journal January 2021
High-entropy alloys journal June 2019
Bayesian-Driven First-Principles Calculations for Accelerating Exploration of Fast Ion Conductors for Rechargeable Battery Application journal April 2018
Bayesian Optimization for Materials Design with Mixed Quantitative and Qualitative Variables journal March 2020
Conversion cathodes for rechargeable lithium and lithium-ion batteries journal January 2017
Multicore–shell iron fluoride@carbon microspheres as a long-life cathode for high-energy lithium batteries journal January 2023
Commentary: The Materials Project: A materials genome approach to accelerating materials innovation journal July 2013
Ab initiomolecular dynamics for liquid metals journal January 1993
Projector augmented-wave method journal December 1994
Electron-energy-loss spectra and the structural stability of nickel oxide: An LSDA+U study journal January 1998
From ultrasoft pseudopotentials to the projector augmented-wave method journal January 1999
Formation enthalpies by mixing GGA and GGA + U calculations journal July 2011
Generalized Gradient Approximation Made Simple journal October 1996
VESTA : a three-dimensional visualization system for electronic and structural analysis journal May 2008
Review: High-Entropy Materials for Lithium-Ion Battery Electrodes journal June 2022