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Oxygen-Deficient Zirconia (ZrO2-x): A New Material for Solar Light Absorption

Scientific reports, 2016-06, Vol.6 (1), p.27218-27218, Article 27218

2016

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Enhanced electrochemical performance of li-ion battery via ultrasonic-assisted inorganic-rich and thin SEI layer

Ultrasonics sonochemistry, 2023-11, Vol.100, p.106620-106620, Article 106620

2023

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Structure-controlled graphene electrocatalysts for high-performance H2O2 production

Energy & environmental science, 2022-01, Vol.15 (7), p.2858-2866

2022

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Development of high-energy non-aqueous lithium-sulfur batteries via redox-active interlayer strategy

Nature communications, 2022-08, Vol.13 (1), p.4629-4629, Article 4629

2022

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Tuning the catalytic activity of heterogeneous two-dimensional transition metal dichalcogenides for hydrogen evolution

Journal of materials chemistry. A, Materials for energy and sustainability, 2018, Vol.6 (41), p.20005-20014

2018

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First principles thermodynamic studies for recycling spent nuclear fuels using electrorefining with a molten salt electrolyte

Energy (Oxford), 2014-04, Vol.68, p.751-755

2014

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Unveiling the Role of Side Chain for Improving Nonvolatile Characteristics of Conjugated Polymers‐Based Artificial Synapse

Advanced science, 2024-04, Vol.11 (16), p.e2400304-n/a

2024

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First-Principles Characterization of the Unknown Crystal Structure and Ionic Conductivity of Li7P2S8I as a Solid Electrolyte for High-Voltage Li Ion Batteries

The journal of physical chemistry letters, 2016-07, Vol.7 (14), p.2671-2675

2016

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First-Principles Study on the Thermal Stability of LiNiO2 Materials Coated by Amorphous Al2O3 with Atomic Layer Thickness

ACS applied materials & interfaces, 2015-06, Vol.7 (21), p.11599-11603

2015

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Reliable and cost effective design of intermetallic Ni2Si nanowires and direct characterization of its mechanical properties

Scientific reports, 2015-10, Vol.5 (1), p.15050-15050, Article 15050

2015

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Electrical transport property of ZnO thin films at high H2 pressures up to 20 bar

Journal of the Korean Physical Society, 2016, 69(3), , pp.277-281

2016

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Unexpectedly high energy density of a Li-Ion battery by oxygen redox in LiNiO2 cathode: First-principles study

Electrochimica acta, 2019-01, Vol.294, p.166-172

2019

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First-Principles Design of Graphene-Based Active Catalysts for Oxygen Reduction and Evolution Reactions in the Aprotic Li–O 2 Battery

The journal of physical chemistry letters, 2016-07, Vol.7 (14), p.2803-2808

2016

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First principles computational study on the adsorption mechanism of organic methyl iodide gas on triethylenediamine impregnated activated carbon

Physical chemistry chemical physics : PCCP, 2016-11, Vol.18 (47), p.325-3256

2016

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First-Principles Computational Screening of Highly Active Pyrites Catalysts for Hydrogen Evolution Reaction through a Universal Relation with a Thermodynamic Variable

Journal of physical chemistry. C, 2018-02, Vol.122 (4), p.2107-2112

2018

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First-principles computational design of unknown flat arsenene epitaxially grown on copper substrate

Applied surface science, 2019-02, Vol.467-468, p.561-566

2019

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Integrated study of first principles calculations and experimental measurements for Li-ionic conductivity in Al-doped solid-state LiGe2(PO4)3 electrolyte

Journal of power sources, 2015-10, Vol.293, p.11-16

2015

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First-principles study on thermodynamic stability of the hybrid interfacial structure of LiMn2O4 cathode and carbonate electrolyte in Li-ion batteries

Physical chemistry chemical physics : PCCP, 2018, Vol.20 (17), p.11592-11597

2018

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First-principles design of highly active and durable Ti55Cx@Pt92 nanocatalyst for oxygen reduction reaction through charge control at nanointerfaces

Applied surface science, 2023-05, Vol.618, p.156685, Article 156685

2023

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First Principles Computational Study of Surface Reactions Toward Design Concepts of High Functional Electrocatalysts for Oxygen Reduction Reaction in a Fuel Cell System

한국표면공학회지, 2017, 50(1), , pp.1-9

2017

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Universal Scaling Relationship To Screen an Efficient Metallic Adsorbent for Adsorptive Removal of Iodine Gas under Humid Conditions: First-Principles Study

Journal of physical chemistry. C, 2018-06, Vol.122 (22), p.11799-11806

2018

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First-Principles Characterization of the Unknown Crystal Structure and Ionic Conductivity of Li 7 P 2 S 8 I as a Solid Electrolyte for High-Voltage Li Ion Batteries

The journal of physical chemistry letters, 2016-07, Vol.7 (14), p.2671-2675

2016

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Sampling rare events using nanostructures for universal Pt neural network potential

Current applied physics, 2024-10, Vol.66, p.110-114

2024

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First-principles study on ultrafast Li-ion diffusion in halospinel Li 2 Sc 2/3 Cl 4 through multichannels designed by aliovalent doping

Journal of materials chemistry. A, Materials for energy and sustainability, 2023-02, Vol.11 (8), p.4272-4279

2023

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First-principles study on ultrafast Li-ion diffusion in halospinel LiScCl through multichannels designed by aliovalent doping

Journal of materials chemistry. A, Materials for energy and sustainability, 2023-02, Vol.11 (8), p.4272-4279

2023

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Oxygen-Deficient Zirconia (ZrO2-x): A New Material for Solar Light Absorption

Enhanced electrochemical performance of li-ion battery via ultrasonic-assisted inorganic-rich and thin SEI layer

Structure-controlled graphene electrocatalysts for high-performance H2O2 production

Development of high-energy non-aqueous lithium-sulfur batteries via redox-active interlayer strategy

Tuning the catalytic activity of heterogeneous two-dimensional transition metal dichalcogenides for hydrogen evolution

First principles thermodynamic studies for recycling spent nuclear fuels using electrorefining with a molten salt electrolyte

Unveiling the Role of Side Chain for Improving Nonvolatile Characteristics of Conjugated Polymers‐Based Artificial Synapse

First-Principles Characterization of the Unknown Crystal Structure and Ionic Conductivity of Li7P2S8I as a Solid Electrolyte for High-Voltage Li Ion Batteries

First-Principles Study on the Thermal Stability of LiNiO2 Materials Coated by Amorphous Al2O3 with Atomic Layer Thickness

Reliable and cost effective design of intermetallic Ni2Si nanowires and direct characterization of its mechanical properties

Electrical transport property of ZnO thin films at high H2 pressures up to 20 bar

Unexpectedly high energy density of a Li-Ion battery by oxygen redox in LiNiO2 cathode: First-principles study

First-Principles Design of Graphene-Based Active Catalysts for Oxygen Reduction and Evolution Reactions in the Aprotic Li–O 2 Battery

First principles computational study on the adsorption mechanism of organic methyl iodide gas on triethylenediamine impregnated activated carbon

First-Principles Computational Screening of Highly Active Pyrites Catalysts for Hydrogen Evolution Reaction through a Universal Relation with a Thermodynamic Variable

First-principles computational design of unknown flat arsenene epitaxially grown on copper substrate

Integrated study of first principles calculations and experimental measurements for Li-ionic conductivity in Al-doped solid-state LiGe2(PO4)3 electrolyte

First-principles study on thermodynamic stability of the hybrid interfacial structure of LiMn2O4 cathode and carbonate electrolyte in Li-ion batteries

First-principles design of highly active and durable Ti55Cx@Pt92 nanocatalyst for oxygen reduction reaction through charge control at nanointerfaces

First Principles Computational Study of Surface Reactions Toward Design Concepts of High Functional Electrocatalysts for Oxygen Reduction Reaction in a Fuel Cell System

Universal Scaling Relationship To Screen an Efficient Metallic Adsorbent for Adsorptive Removal of Iodine Gas under Humid Conditions: First-Principles Study

First-Principles Characterization of the Unknown Crystal Structure and Ionic Conductivity of Li 7 P 2 S 8 I as a Solid Electrolyte for High-Voltage Li Ion Batteries

Sampling rare events using nanostructures for universal Pt neural network potential

First-principles study on ultrafast Li-ion diffusion in halospinel Li 2 Sc 2/3 Cl 4 through multichannels designed by aliovalent doping

First-principles study on ultrafast Li-ion diffusion in halospinel LiScCl through multichannels designed by aliovalent doping

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