110. G. Choi+, S. Hong+, N. T. Y. Phan+, H. Shin*, J. Lim*, Surface-State Engineered Copper Phosphide as a Durable Peroxymonosulfate Activator
for Wastewater Treatment: From Activity Enhancement to Scale-up Demonstration, Small, Just accepted (2026) +equal contribution
108. Y. Kim+, J. Jeong+, D. K. Na, Y. Jeong, Y. J. Kim, H. Kim, H. Shin*, J. Y. Park*, Atomic-scale Unveiling of the True Active Phase of Mn Porphyrin Catalysts on Au(111) using Electrochemical Scanning Tunneling Microscopy, J. Am. Chem. Soc., Just accepted (2026) +equal contribution
36(80), e77931 (2026)
Chem. Eng. J., 546, 180201 (2026)
100. J. Lim+, J. Ham+, M. Ko+, G. H. Jo, I. B. Heo, K. S. Kim, H. Kim, J. H. Lim, H. Shin*, N. Jeon*, H. M. Jin*, Metal/Metal-Oxide Heterostructured
light, Appl. Surf. Sci. Adv., 34, 100996 (2026)
Zinc-Vanadium Redox Flow Batteries, Korean J. Chem. Eng., 43, 2557-2563 (2026) +equal contribution
15114-15124 (2026) + equal contribution
batteries, Nano Energy, 152, 111862 (2026)
Evolution Reaction Kinetics in Acids, ACS Catal., 16(6), 5426-5431 (2026) +equal contribution
Ammonia Oxidation Electrocatalysis, Adv. Sci., 13(17), e21932 (2026) +equal contribution
Three-Dimensional Nanohole Structures, Chem. Mater., 38(2), 853-861 (2026) + equal contribution
using CuO electrocatalysts, J. Mater. Chem. A, 14(8), 4640-4651 (2026) +equal contribution
Catal. Today, 463, 115607 (2026) + equal contribution
MoxNbyV1-(x+y)Se2 Alloys, Korean J. Chem. Eng., 43(1), 97-107 (2026)
Adv. Funct. Mater., 36(16), e21020 (2026) + equal contribution
Appl. Catal. B-Environ. Energy, 382, 125947 (2026) + equal contribution
photosynthesis, Chem. Eng. J., 515, 163915 (2025) + equal contribution
Bull. Korean Chem. Soc., 46(5), 554-561 (2025) + equal contribution
of 5‑Hydroxymethylfurfural on Amorphous Nickel Oxyhydroxide, ACS Catal, 15(9), 6906-6917 (2025)
Engineering, ChemSusChem, 18(13), e202402763 (2025) + equal contribution
Acidic Electrochemical CO2 Reduction Reaction, J. Am. Chem. Soc., 147(15), 12996-13007 (2025)
accelerating acidic CO2 reduction reaction, Chem, 11(8), 102461 (2025) + equal contribution
159874 (2025) +equal contribution
directions, Inorg. Chem. Front., 12(7), 2587-2612 (2025) +equal contribution
60. J. Seok+, N. T. Y. Phan+, J.-C. Kim, H. Shin*, M. Choi*, Catalytic Synergy between Lewis Acidic Alumina and Pt in Hydrodechlorination for
Plastic Chemical Recycling, J. Am. Chem. Soc., 146(34), 23881-23890 (2024) - reported in the media + equal contribution
59. D. Shin+, Y. Jeon+, V. T. Nguyen+, S. Kang, Y. Hong, C. Lim, K. Yong, H. Shin*, Y. J. Hwang*, Insight into Fluoride Additives to Enhance Ammonia Production from Lithium-Mediated Electrochemical Nitrogen Reduction Reaction, Small, 20(40), 2404525 (2024)
- selected as a top 10% most-viewed paper in Small (2024) +equal contribution
Electroreduction of Nitrite to Ammonia, Small Struct., 5(9), 2400187 (2024) +equal contribution
Chem. Eng. J., 495, 153108 (2024)
urine wastewater treatment, Chem. Eng. J., 493, 152698 (2024)
2401198 (2024) - reported in the media + equal contribution
of Bi2S3-Derived Bi Nanoplates: Enhanced Catalytic Activity and Selectivity in Electrochemical and Photoelectrochemical CO2 Reduction to
Formate, Adv. Sci., 11(28), 2400874 (2024) +equal contribution
52. N. Nwaji+, G. M. Zewdie+, J. Gwak, H. Kang, L. T. Tufa, Y. Choi, M. Goddati, H. Shin*, J. Lee*, Dimeric Ni-Co single-atom anchored on ultrathin
N-doped 2D molybdenum carbide boosted performance in solid-state supercapacitor, J. Energy Storage, 83, 110671 (2024)
+equal contribution
51. W.-G. Lim+, N. H. Truong+, J.-Y. Jeong, D. Kim, L. S. Oh, C. Jo, C. Kim, H. J. Kim, S. M. Choi, H. Shin*, S. Lee*, E. Lim*, Toward feasible single atom-based hydrogen evolution electrocatalysts via artificial ensemble sites for anion exchange membrane water electrolyzer,
Appl. Catal. B- Environ., 343, 123568 (2024) +equal contribution
49. C. Lim, D. Kim, M. Kim, H. Yun, D. Shin, Y. J. Hwang, H. Shin, K. Yong*, Effect of Sulfur-Derived Solid Electrolyte Interphase on Li-mediated Nitrogen Reduction, ACS Energy Lett. 8(11), 4875-4884 (2023)
48. S. Jo, S. Im, S. Weon, H. Shin*, J. Lim*, Reduced TiO2 nanotube arrays as environmental catalysts that enable advanced oxidation
processes: A mini review, Chem. Eng. J., 477, 147031 (2023)
-Invited for a special issue on "Emerging Trends on the Role of AOPs in Water Reuse Applications".
47. H. Lee, W. A. Goddard III, J. Cha, W. J. Choi*, S. H. Noh*, H. Shin*, H. Kim*, Functional Group-Dependent Proton Conductivity of Phosphoric Acid-Doped Ion-Pair Coordinated Polymer Electrolytes: A Molecular Dynamics Study, J. Phys. Chem. B, 127(41), 8993-8999 (2023)
46. J. Park, M. Jeong, Y. J. Cho, K. J. Kim, T. B. Tai, H. Shin, J. C. Lim, H. S. Chang*, Investigation of tetrakis(ethylmethylamido)hafnium adsorption mechanism in initial growth of atomic layer deposited-HfO2 thin films on H-/OH-terminated Si (100) surfaces, J. Vac. Sci. Technol. B, 41(6), 062801 (2023)
45. R. S. Kanase, G. M. Zewdie, M. Arunachalam, J. Badiger, S. A. Sayed, K.-S. Ahn, J.-S. Ha, U. Sim, H. Shin*, S. H. Kang*, Surface engineering
of ZnO electrocatalyst by N doping towards electrochemical CO2 reduction, J. Energy Chem., 88, 71-81 (2023)
44. H. S. Moon, B. Song, J. Jeon, T.-H. Lai, Y.-P. Chang, Y.-D. Lin, J. K. Park, Y.-G. Lin, Y.-J. Hsu, H. Shin, Y. Yun, K. Yong*, Atomically isolated copper
on titanium dioxide for ammonia photosynthesis via nitrate reduction with unprecedently high apparent quantum yield,
Appl. Catal. B- Environ., 339, 123185 (2023)
43. Y. A. Lee+, K. Y. Jang+, J. Yoo+, K. Yim, W. Jung, K. Jung, C. Yoo, Y. Cho, J. Lee, M. H. Ryu, H. Shin*, K. Lee*, H. Yoon*, Three-Dimensional Flower-like MoS2 Nanosheets Grown on Graphite as High-Performance Anode Materials for Fast-Charging Lithium-Ion
Batteries, Materials, 16(11), 4016 (2023) -highlighted as a front cover +equal contribution
41. M. S. Kim, H. Y. Yoo, G. E. Choi, S. Jo, H. Shin, J. Lim*, Visible Light Photocatalysis of TiO2 Complexed with Albumin via a Ligand-to-Metal
Charge Transfer (LMCT) Pathway, J. Phys. Chem. C, 127(11), 5408-5415 (2023)
40. T. B. Tai, J. Son, H. Shin*, A theoretical study of the atomic layer deposition of HfO2 on Si(100) surfaces using tetrakis(ethylmethylamino) hafnium and water, Appl. Surf. Sci., 612, 155702 (2023)
39. H. M. Choi, S. J. Jun, J. Lee, M.-H. Ryu, H. Shin*, K.-N. Jung*, UV-cured Polymer Solid Electrolyte Reinforced using a Ceramic-Polymer
Composite Layer for Stable Solid-State Li Metal Batteries, J. Electrochem. Sci. Technol., 14(1), 85-95 (2023)
38. W. Jung, J. Jeong, Y. Chae, W. H. Lee, Y.-J. Ko, K. H. Chae, H.-S. Oh, U. Lee, D. K. Lee, B. K. Min, H. Shin*, Y. J. Hwang*, D. H. Won*,
Synergistic bimetallic CuPd oxide alloy electrocatalyst for ammonia production from the electrochemical nitrate reaction,
J. Mater. Chem. A, 10(44), 23760-23769 (2022)
37. D. Shin, H. Choi, J. An, C-H. Choi, C.-H. Sohn, H. Shin*, H. Kim*, Enhanced electroreduction of CO2 by Ni−N−C catalysts from the interplay
between valency and local coordination symmetry, J. Mater. Chem. A, 10(42), 22523-22530 (2022)
36. H. Roh, H. Choi, J.-S. Kim, H. Shin, T. Park, K. Yong*, Low power consumed PV-electrolysis with CoFeP nanowires for hydrazine-assisted
hydrogen production, Appl. Surf. Sci., 606, 154951 (2022)
Small, 18(45), 2204797 (2022) -highlighted as a front cover
34. Y. Sun+, H. Shin+, F. Wang+, B. Tian, C.-W. Chiang, S. Liu, X. Li, Y. Wang, L. Tang, W. A. Goddard*, M. Ding*, Highly Selective Electrocatalytic
Oxidation of Amines to Nitriles Assisted by Water Oxidation on Metal-Doped α-Ni(OH)2, J. Am. Chem. Soc., 144(33), 15185-15192 (2022)
33. S. Garain, C. D. Van, S. Choi, T. N. Dang, J. W. Ager, K. T. Nam, H. Shin*, M. H. Lee*, Hierarchical Thiospinel NiCo2S4/Polyaniline Hybrid
Nanostructures as a Bifunctional Electrocatalyst for Highly Efficient and Durable Overall Water Splitting, Adv. Mat. Interfaces, 9(25),
2200649 (2022)
32. J. Min+, S. Kim+, A. A. Jeffery, H. Shin, Y. S. Kang, Y. Kim, J. Jang, S. Lee, S.-H. Park, G.-G. Park, S. J. Yoo, S.-D. Yim*, N. Jung*, A paradigm
shift in CO tolerant catalyst design for fuel cells via introducing defect-controlled carbon molecular sieve layers, Mater. Today Energy,
29, 101124 (2022) +equal contribution
31. H. Y. Yoo, M. S. Kim, H. Shin*, J. Lim*, Peroxymonosulfate activation by black TiO2 nanotube arrays under solar light: Switching the
activation mechanism and enhancing catalytic activity and stability, J. Hazard. Mater., 433, 128796 (2022)
30. H. C. Kwon, Y. Park, J. Y. Park, R. Ryoo, H. Shin*, M. Choi*, Catalytic Interplay of Ga, Pt, and Ce on the Alumina Surface Enabling High Activity,
Selectivity, and Stability in Propane Dehydrogenation, ACS Catal., 11(17), 10767-10777 (2021)
(2021) -selected as a Hot Paper +equal contribution
28. N. Kim, T.-H. Gu, D. Shin, X. Jin, H. Shin, M. G. Kim, H. Kim*, S.-J. Hwang*, Lattice Engineering to Simultaneously Control the
Defect/Stacking Structures of Layered Double Hydroxide Nanosheets to Optimize Their Energy Functionalities, ACS Nano, 15(5), 8306-8318
(2021)
27. J. Wang*, S.-J. Kim, J. Liu, Y. Gao, S. Choi, J. Han, H. Shin, S. Jo, J. Kim, F. Ciucci, H. Kim, Q. Li, W. Yang, X. Long, S. Yang*, S.-P. Cho, K. H. Chae,
M. G. Kim, H. Kim*, J. Lim*, Redirecting dynamic surface restructuring of a layered transition metal oxide catalyst for superior water
oxidation, Nat. Catal., 4(3), 212-222 (2021) -highlighted as a front cover
26. C. Liu, J. Qian, Y. Ye, H. Zhou, C.-J. Sun, C. Sheehan, Z. Zhang, G. Wan, Y.-S. Liu, J. Guo, S. Li, H. Shin, S. Hwang, T. B. Gunnoe, W. A. Goddard*,
S. Zhang*, Oxygen evolution reaction over catalytic single-site Co in a well-defined brookite TiO2 nanorod surface, Nat. Catal., 4(1), 36-45
25. I. Jang, K. Im, H. Shin, K.-S. Lee, H. Kim, J. Kim, S. J. Yoo*, Electron-deficient titanium single-atom electrocatalyst for stable and efficient
hydrogen production, Nano Energy, 78, 105151 (2020)
24. L.-A. Huang+, H. Shin+, W. A. Goddard*, J. Wang*, Photochemically deposited Ir-doped NiCo oxyhydroxide nanosheets provide
highly efficient and stable electrocatalysts for the oxygen evolution reaction, Nano Energy, 75, 104885 (2020) +equal contribution
23. D. H. Won, H. Shin, M. W. Chung, H. Jung, K. H. Chae, H.-S. Oh, Y. J. Hwang*, B. K. Min*, Achieving tolerant CO2 electro-reduction catalyst in
real water matrix, Appl. Catal. B-Environ., 258, 117961 (2019)
22. H. Shin, H. Xiao, W. A. Goddard*, In Silico Discovery of New Dopants for Fe-Doped Ni Oxyhydroxide (Ni1-xFexOOH) Catalysts for Oxygen
Evolution Reaction, J. Am. Chem. Soc., 140(22), 6745-6748 (2018)
-selected as one of the most highly cited publications in JACS for the period 2018-2019
21. H. Xiao, H. Shin, W. A. Goddard*, Synergy between Fe and Ni in the optimal performance of (Ni,Fe)OOH catalysts for the oxygen evolution reaction, Proc. Natl. Acad. Sci., 115(23), 5872-5877 (2018)
20. S.-W. Baek, S. -H. Lee, J. H. Song, C. Kim, Y. -S. Ha, H. Shin, H. Kim, S. Jeong, J. -Y. Lee*, A hydro/oxo-phobic top hole-selective layer for
efficient and stable colloidal quantum dot solar cells, Energy Environ. Sci., 11(8), 2078-2084 (2018)
19. J. Lim, H. Shin, M. Kim, H. Lee, K.-S. Lee, Y. Kwon, D. Song, S. Oh, H. Kim, E. Cho*, Ga-Doped Pt-Ni Octahedral Nanoparticles as a Highly
Active and Durable Electrocatalyst for Oxygen Reduction Reaction, Nano Lett., 18(4), 2450-2458 (2018)
18. X. Jin, J. Lim, Y. Ha, N. H. Kwon, H. Shin, I. Y. Kim, N. S. Lee, M. H. Kim, H. Kim*, S. J. Hwang*, A critical role of catalyst morphology in low-
temperature synthesis of carbon nanotube−transition metal oxide nanocomposite, Nanoscale, 9(34), 12416-12424 (2017)
17. I. Choi+, H. Y. Jeong+, H. Shin, G. Kang, M. Byun, H. Kim, A. M. Chitu, J. S. Im, R. S. Ruoff, S.-Y. Choi, K. J. Lee*, Laser-induced phase
separation of silicon carbide, Nat. Commun, 7(1), 13562 (2016) +equal contribution
16. H. Shin, Y. Ha, H. Kim*, 2D Covalent Metals: A New Materials Domain of Electrochemical CO2 Conversion with Broken Scaling Relationship,
J. Phys. Chem. Lett, 7(20), 4124-4129 (2016)
15. P. P. Upare, J. W. Yoon, D. W. Hwang, U.-H. Lee, Y. K. Hwang, D.-Y. Hong, J. C. Kim, J. H. Lee, S. K. Kwak, H. Shin, H. Kim, J.-S. Chang*, Design
of a heterogeneous catalytic process for the continuous and direct synthesis of lactide from lactic acid, Green Chem., 18(22), 5978-5983
14. D. H. Won, H. Shin, J. Koh, J. Chung, H. S. Lee, H. Kim*, and S. I. Woo*, Highly Efficient, Selective, and Stable CO2 Electroreduction on a
Hexagonal Zn Catalyst, Angew. Chem. Int. Ed, 55(32), 9297-9300 (2016)
13. H. Shin, M. Choi, H. Kim*, A mechanistic model for hydrogen activation, spillover, and its chemical reaction in a zeolite-encapsulated Pt
catalyst, Phys. Chem. Chem. Phys., 18(10), 7035-7041 (2016) -highlighted as an inside front cover
12. N. Jung+, H. Shin+, M. Kim, I. Jang, H.-J. Kim, E. Cho, J. H. Jang, H. Kim*, S. J. Yoo*, Janus Pt surfaces derivatized with zwitterionic
molecules for oxygen reduction reactions in alkaline and acid electrolytes, Nano Energy, 17, 152-159 (2015) +equal contribution
11. D. Y. Chung, Y.-H. Chung, S. Kim, J. W. Lim, K. J. Lee, N. Jung, H. Shin, O.-H. Kim, H. Kim, S. J. Yoo*, Y.-E. Sung*, Understanding Interface
between Electrode and Electrolyte: Organic/Inorganic Hybrid Design for Fast Ion Conductivity, J. Phys. Chem. C, 119(17), 9169-9176 (2015)
aluminosilicates with controlled nanostructures, Nat. Commun, 5(1), 3370 (2014) +equal contribution
9. H.-K. Lim+, H. Shin+, W. A. Goddard, Y. J. Hwang, B. K. Min, H. Kim*, Embedding Covalency into Metal Catalysts for Efficient Electrochemical
Conversion of CO2, J. Am. Chem. Soc., 136(32), 11355-11361 (2014) +equal contribution
7. S. Yook+, H. Shin+, H. Kim*, M. Choi*, Selective Dissociation of Dihydrogen over Dioxygen on a Hindered Platinum Surface for the Direct
Synthesis of Hydrogen Peroxide, ChemCatChem, 6(10), 2836-2842 (2014) +equal contribution
6. C. H. Choi, H. C. Kwon, S. Yook, H. Shin, H. Kim, M. Choi*, Hydrogen Peroxide Synthesis via Enhanced Two-Electron Oxygen Reduction
Pathway on Carbon-Coated Pt Surface, J. Phys. Chem. C, 118(51), 30063-30070 (2014)
5. C. H. Choi+, H.-K. Lim+, M. W. Chung, J. C. Park, H. Shin, H. Kim*, S. I. Woo*, Long-Range Electron Transfer over Graphene-Based Catalyst for
High-Performing Oxygen Reduction Reactions: Importance of Size, N-doping, and Metallic Impurities, J. Am. Chem. Soc., 136(25),
9070-9077 (2014) +equal contribution
4. D.-H. Seo, H. Shin, K. Kang, H. Kim*, S. S. Han*, First-Principles Design of Hydrogen Dissociation Catalysts Based on Isoelectronic Metal
Solid Solutions, J. Phys. Chem. Lett., 5(11), 1819-1824 (2014)
3. B. J. Yang, H. Shin, H. Kim, H. K. Lee*, Strain rate and adhesive energy dependent viscoplastic damage modeling for nanoparticulate
composites: Molecular dynamics and micromechanical simulations, Appl. Phys. Lett., 104(10), 101901 (2014)
2. B. J. Yang, H. Shin, H. K. Lee, H. Kim*, A combined molecular dynamics/micromechanics/finite element approach for multiscale
constitutive modeling of nanocomposites with interface effects, Appl. Phys. Lett., 103(24), 241903 (2013)
1. H. Shin, T. A. Pascal, W. A. Goddard*, H. Kim*, Scaled Effective Solvent Method for Predicting the Equilibrium Ensemble of Structures with
Analysis of Thermodynamic Properties of Amorphous Polyethylene Glycol-Water Mixtures, J. Phys. Chem. B, 117(3), 916-927 (2013)