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Yongwoo Shin
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Computational predictions of energy materials using density functional theory
A Jain, Y Shin, KA Persson
Nature Review Materials 1, 15004, 2016
6962016
Elucidating the Solvation Structure and Dynamics of Lithium Polysulfides Resulting from Competitive Salt and Solvent Interactions
NN Rajput, V Murugesan, Y Shin, KS Han, KC Lau, J Chen, J Liu, ...
Chemistry of Materials 29 (8), 3375-3379, 2017
1342017
CO2 doping of organic interlayers for perovskite solar cells
J Kong, Y Shin, JA Röhr, H Wang, J Meng, Y Wu, A Katzenberg, G Kim, ...
Nature 594 (7861), 51-56, 2021
1292021
Light-Induced Self-Assembly of Cubic CsPbBr3 Perovskite Nanocrystals into Nanowires
J Liu, K Song, Y Shin, X Liu, J Chen, KX Yao, J Pan, C Yang, J Yin, LJ Xu, ...
Chemistry of Materials 31 (17), 6642-6649, 2019
1262019
Revealing the Intrinsic Li Mobility in the Li2MnO3 Lithium-excess Material
Y Shin, H Ding, KA Persson
Chemistry of Materials 28 (7), 2081-2088, 2016
692016
Alleviating oxygen evolution from Li-excess oxide materials through theory-guided surface protection
Y Shin, WH Kan, M Aykol, JK Papp, BD McCloskey, G Chen, KA Persson
Nature communications 9 (1), 1-8, 2018
582018
25Mg NMR and computational modeling studies of the solvation structures and molecular dynamics in magnesium based liquid electrolytes
JZ Hu, NN Rajput, C Wan, Y Shao, X Deng, NR Jaegers, M Hu, Y Chen, ...
Nano energy 46, 436-446, 2018
412018
Structure and optical bandgap relationship of π-conjugated systems
AL Botelho, Y Shin, J Liu, X Lin
PLoS One 9 (1), 2014
412014
Surface Morphology and Surface Stability against Oxygen Loss of the Li-excess Li2MnO3 Cathode Material as a function of Li concentration
Y Shin, KA Persson
ACS Applied Materials & Interfaces 8 (38), 25595–25602, 2016
36*2016
Revealing the structural degradation mechanism of the Ni-rich cathode surface: How thick is the surface?
YS Kang, SY Park, K Ito, Y Kubo, Y Shin, DY Kim, DH Seo, S Kim, JH Park, ...
Journal of Power Sources 490, 229542, 2021
252021
Combinatorial Design of Copolymer Donor Materials for Bulk Heterojunction Solar Cells
Y Shin, J Liu, JJ Quigley, H Luo, X Lin
ACS nano 8 (6), 6089-6096, 2014
222014
Unified hamiltonian for conducting polymers
AL Botelho, Y Shin, M Li, L Jiang, X Lin
Journal of Physics: Condensed Matter 23 (45), 455501, 2011
222011
Ni-stabilizing additives for completion of Ni-rich layered cathode systems in lithium-ion batteries: An Ab initio study
DY Kim, I Park, Y Shin, DH Seo, YS Kang, SG Doo, M Koh
Journal of Power Sources 418, 74-83, 2019
192019
The molecular mechanism of conformational changes of the triplet prion fibrils for pH
H Choi, HJ Chang, Y Shin, JI Kim, HS Park, G Yoon, S Na
RSC Advances 5, 49263–49269, 2015
162015
Predicting oxygen vacancy non-stoichiometric concentration in perovskites from first principles
H Luo, Y Shin, Y Yu, D Cetin, K Ludwig, U Pal, SN Basu, S Gopalan, X Lin
Applied Surface Science 323, 65-70, 2014
122014
Modeling Photoinduced Charge Transfer Across π-Conjugated Heterojunctions
Y Shin, X Lin
Journal of Physical Chemistry C 117, 12432-12437, 2013
122013
Escape mechanism of a self-trapped topological soliton
Y Shin, M Li, AL Botelho, X Lin
Physical Review B 82 (19), 193101, 2010
92010
Self-localized domain walls at π-conjugated branching junctions
Y Shin, X Lin
Journal of Chemical Physics 135 (22), 224903, 2011
42011
Deliberate Charge Conjugation Symmetry Breaking for π-Conjugated Electron Acceptor Design
Y Shin, X Lin
Journal of Physical Chemistry C 119 (23), 12808−12814, 2015
32015
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Articles 1–19