Gyeong S. Hwang

university of texas at austin

H指数:46

被引数:1.0万

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First-Principles Prediction of the Protective Effect of Sulfur in Composite Ni/Ni3S2 Hydrogen Evolution Catalysts

基于第一性原理预测硫在复合Ni/Ni3S2析氢催化剂中的保护作用

The Journal of Physical Chemistry C

IF3.2

2025-11-030

PRE

Revealing the dominant reactive oxygen species in aqueous amine solutions for carbon capture

揭示碳捕获中水合胺溶液中的主要活性氧物种

Phys. Chem. Chem. Phys.

IF2.9

2025-10-010

OAAI

Prediction of Cyclic Stress-Induced Mechanical Failure in Sulfide-Based Solid Electrolytes: A Reactive Molecular Dynamics Study

硫化物基固体电解质中循环应力诱导的机械失效预测：一项反应性分子动力学研究

ACS Applied Energy Materials

IF5.5

2025-09-150

PRE

First-Principles Prediction of the Critical Role of Superoxide Anions in Oxidative Degradation of Aqueous Amine Solvents for Carbon Dioxide Capture

基于第一性原理预测超氧阴离子在二氧化碳捕获中水溶性胺溶剂氧化降解中的关键作用

Industrial & Engineering Chemistry Research

IF3.9

2025-08-040

PRE

Origin of Lithium Dendrite Formation in Sulfide-Based Electrolyte

硫化物基电解质中锂枝晶形成的原因

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

IF16.9

2025-04-210

PRE

Lithium Storage Mechanisms and Electrochemical Behavior of a Molybdenum Disulfide Nanoparticle Anode

二硫化钼纳米颗粒负极的储锂机理及电化学行为

ENERGY & ENVIRONMENTAL MATERIALS

IF14.1

2024-12-070

First-Principles Prediction of Reaction-Induced Structural Evolution at the Interface between Lithium Metal and Sulfide Electrolytes

第一性原理预测锂金属和硫化物电解质之间的界面处反应诱导的结构演变

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2024-03-080

PRE

Structural Toughness of Fluorinated-Nitrided Interphase Passivation Layers for Lithium-Ion Batteries: A Reactive Molecular Dynamics Study

锂离子电池氟化氮化相间钝化层的结构韧性: 反应分子动力学研究

ACS APPLIED MATERIALS & INTERFACES

IF8.2

2024-03-040

PRE

Synergetic impact of nitrate-based additives for enhanced solid electrolyte interphase performance

硝酸盐基添加剂对增强固体电解质相间性能的协同影响

JOURNAL OF MATERIALS CHEMISTRY A

IF9.5

2024-01-012

PRE

Amorphization of Inorganic Solid Electrolyte Interphase Components and Its Impact on Enhancing Their Transport and Mechanical Properties

无机固体电解质相间组分的非晶化及其对增强其输运和力学性能的影响

ACS APPLIED MATERIALS & INTERFACES

IF8.2

2023-12-142

PRE

Silicon Nitride Surface Modification by Ion Bombardment with Physisorbed Hydrofluorocarbons: Theoretical Assessment

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2023-12-050

PRE

Ammonium chloride (-NH3+Cl-) salt formation from dichlorosilane decomposition and its potential impact on silicon nitride atomic layer deposition

APPLIED SURFACE SCIENCE

IF6.9

2023-08-012

PRE

Low-energy argon ion bombardment-induced decomposition of physisorbed hydrofluorocarbons on silicon nitride surfaces: A computational mechanistic study

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2023-07-071

Anomalous doping effects on stabilizing unusual phases of lithium fluoride for enhanced rechargeable battery interfaces

异常掺杂对增强的可充电电池界面稳定氟化锂异常相的影响

ACTA MATERIALIA

IF9.3

2023-04-014

PRE

First-principles assessment of chemical lithiation of sulfide solid electrolytes and its impact on their transport, electronic and mechanical properties

JOURNAL OF POWER SOURCES

IF7.9

2023-03-018

PRE

Elucidating the mechanism underlying the augmented capacity of MoO2 as an anode material in Li-ion batteries

阐明MoO2作为锂离子电池负极材料容量增加的机理

JOURNAL OF MATERIALS CHEMISTRY A

IF9.5

2023-01-014

PRE

Synthetic Control of Intrinsic Defect Formation in Metal Oxide Nanocrystals Using Dissociated Spectator Metal Salts

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

IF15.6

2022-12-069

Probing strong steric hindrance effects in aqueous alkanolamines for CO2 capture from first principles

JOURNAL OF ENVIRONMENTAL CHEMICAL ENGINEERING

IF7.2

2022-12-0111

PRE

Development of a monoethanolamine/n-butanol biphasic solution with tunable phase separation for CO2 absorption via combined experimental and computational study: Role of solvation environment, phase separation mechanism

SEPARATION AND PURIFICATION TECHNOLOGY

IF9

2022-11-0115

PRE

Combined experimental and computational study on the promising monoethanolamine+2-(ethylamino)ethanol plus sulfolane biphasic aqueous solution for CO2 absorption

有前途的单乙醇胺2-(乙氨基) 乙醇加环丁砜双相水溶液吸收CO2的实验和计算研究

CHEMICAL ENGINEERING JOURNAL

IF13.2

2022-10-0129

PRE

Gyeong S. Hwang

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