Iron-Based Perovskites for Catalyzing Oxygen Evolution Reaction

Binghong Han , Alexis Grimaud , Livia Giordano , Wesley T. Hong
Journal of Physical Chemistry C 122 ( 15) 8445 -8454

101
2018
Activity and stability trends of perovskite oxides for oxygen evolution catalysis at neutral pH

Yang Shao-Horn , Binghong Han , Chen Ling , Marcel Risch
Prof. Shao-Horn via Angie Locknar

114
2015
Density functional theory modeling of cation diffusion in tetragonal bulk ZrO2 : Effects of humidity and hydrogen defect complexes on cation transport

Dan C. Sorescu , Yuhua Duan , Dane Morgan , Gregory Hackett
Physical Review Research 3 ( 1) 013121

2021
First Principles Investigation of Oxygen Vacancies in Columbite MNb2O6 (M = Mn, Fe, Co, Ni, Cu)

M. E. Arroyo y de Dompablo , Yueh-Lin Lee , D. Morgan
Chemistry of Materials 22 ( 3) 906 -913

18
2010
Ab initio energetics of charge compensating point defects: A case study on MgO

Dane Morgan , Shih-kang Lin , Chao-kuei Yeh , Brian Puchala
Computational Materials Science 73 ( 73) 41 -55

6
2013
Corrigendum to “Ab initio energetics of charge compensating point defects: A case study on MgO” [Comput. Mater. Sci. 73 (2013) 41–55]

Shih-kang Lin , Chao-kuei Yeh , Brian Puchala , Yueh-Lin Lee
Computational Materials Science 109 104

1
2015
Prediction of Surface Oxygen Vacancy Concentrations of (La1-xSrx)MnO3

Yueh-Lin Lee , Dane Morgan
216th ECS Meeting 25 ( 2) 2769 -2774

25
2009
Kinetics of Oxygen Surface Exchange on Epitaxial Ruddlesden–Popper Phases and Correlations to First-Principles Descriptors

Xiao Renshaw Wang , Ho Nyung Lee , Dane Morgan , Yang Shao-Horn
Journal of Physical Chemistry Letters 7 ( 2) 244 -249

34
2016
Oxygen Point Defect Chemistry in Ruddlesden–Popper Oxides (La1–xSrx)2MO4±δ (M = Co, Ni, Cu)

Wei Xie , Yueh-Lin Lee , Yang Shao-Horn , Dane Morgan
Journal of Physical Chemistry Letters 7 ( 10) 1939 -1944

52
2016
Enhanced Oxygen Surface Exchange Kinetics and Stability on Epitaxial La0.8Sr0.2CoO3−δ Thin Films by La0.8Sr0.2MnO3−δ Decoration

Dongkyu Lee , Yueh-Lin Lee , Alexis Grimaud , Wesley T. Hong
The Journal of Physical Chemistry C 118 ( 26) 14326 -14334

21
2014
Ab initio energetics of LaBO3(001) (B=Mn, Fe, Co, and Ni) for solid oxide fuel cell cathodes

Yueh-Lin Lee , Jesper Kleis , Jan Rossmeisl , Dane Morgan
Physical Review B 80 ( 22) 224101

485
2009
Tritium Diffusion Pathways in γ-LiAlO2 Pellets Used in TPBAR: A First-Principles Density Functional Theory Investigation

Hari P. Paudel , Yueh-Lin Lee , David J. Senor , Yuhua Duan
Journal of Physical Chemistry C 122 ( 18) 9755 -9765

14
2018
Strontium influence on the oxygen electrocatalysis of La2−xSrxNiO4±δ (0.0 ≤ xSr ≤ 1.0) thin films

Dongkyu Lee , Yueh-Lin Lee , Alexis Grimaud , Wesley T. Hong
Journal of Materials Chemistry 2 ( 18) 6480 -6487

28
2014
Joint experimental and computational 17O solid state NMR study of Brownmillerite Ba2In2O5

Rıza Dervişoğlu , Derek S. Middlemiss , Frédéric Blanc , Lesley A. Holmes
Physical Chemistry Chemical Physics 16 ( 6) 2597 -2606

7
2014
7
2017
Ab initio and empirical defect modeling of LaMnO3±δ for solid oxide fuel cell cathodes

Yueh-Lin Lee , Dane Morgan
Physical Chemistry Chemical Physics 14 ( 1) 290 -302

39
2012
Joint Experimental and Computational 17O and 1H Solid State NMR Study of Ba2In2O4(OH)2 Structure and Dynamics.

Rıza Dervişoğlu , Derek S. Middlemiss , Frédéric Blanc , Yueh-Lin Lee
Chemistry of Materials 27 ( 11) 3861 -3873

31
2015
11
2016
Solid-state activation of Li2O2 oxidation kinetics and implications for Li–O2 batteries

Koffi P. C. Yao , Marcel Risch , Sayed Youssef Sayed , Yueh-Lin Lee
Energy and Environmental Science 8 ( 8) 2417 -2426

76
2015