On the application of Marcus–Hush theory to small polaron chemical dynamics in oxides: its relationship to the Holstein model and the importance of lattice–orbital symmetries
Zi Wang(McGill University), Kirk H. Bevan(McGill University), Shuaishuai Yuan(McGill University), Bobby Miglani(McGill University)
Cited by 10
Related Papers
Implications of the <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:mrow><mml:mi mathvariant="normal">DFT</mml:mi><mml:mo>+</mml:mo><mml:mi>U</mml:mi></mml:mrow></mml:math> method on polaron properties in energy materials
|Physical review. B./Physical review. B|2017|40
Measuring Spatially Resolved Collective Ionic Transport on Lithium Battery Cathodes Using Atomic Force Microscopy
|Nano Letters|2017|37
Exploring the impact of semicore level electronic relaxation on polaron dynamics: An adiabatic<i>ab initio</i>study of<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:msub><mml:mi>FePO</mml:mi><mml:mn>4</mml:mn></mml:msub></mml:math>
|Physical review. B./Physical review. B|2016|33
Computational design of spatially confined triatomic catalysts for nitrogen reduction reaction
|Journal of Materials Informatics|2023|18
<i>Ab initio</i>insight into the formation of small polarons: A study across four metal peroxides
|Physical review. B./Physical review. B|2019|16