Sung-Yup Kim

发表

Atomistic Simulation Derived Insight on the Irreversible Structural Changes of Si Electrode during Fast and Slow Delithiation.

Yue Qi, Kwang Jin Kim, Sung-Yup Kim, 2017, Nano letters.

Atomic Insight into the Lithium Storage and Diffusion Mechanism of SiO2/Al2O3 Electrodes of Lithium Ion Batteries: ReaxFF Reactive Force Field Modeling.

Yue Qi, Ekin D Cubuk, Sung-Yup Kim, 2016, The journal of physical chemistry. A.

Toward the multiscale nature of stress corrosion cracking

Bo-Young Lee, Sang Soo Han, Woonggi Hwang, 2017 .

Property Evolution of Al 2 O 3 Coated and Uncoated Si Electrodes : A First Principles Investigation

Sung-Yup Kim, Yue Qiz, 2014 .

Self-generated concentration and modulus gradient coating design to protect Si nano-wire electrodes during lithiation.

Huajian Gao, A. V. van Duin, Xingcheng Xiao, 2016, Physical chemistry chemical physics : PCCP.

Exploration of the Conformational and Reactive Dynamics of Glycine and Diglycine on TiO2: Computational Investigations in the Gas Phase and in Solution

A. V. Duin, V. Barone, S. Monti, 2012 .

Property Evolution of Al2O3 Coated and Uncoated Si Electrodes: A First Principles Investigation

Y. Qi, Sung-Yup Kim, 2014 .

ReaxFF Reactive Force Field Study of the Dissociation of Water on Titania Surfaces

K. Fichthorn, Sung-Yup Kim, M. Raju, 2013 .

Development of a ReaxFF reactive force field for titanium dioxide/water systems.

Nitin Kumar, Petter Persson, Sung-Yup Kim, 2012, Langmuir : the ACS journal of surfaces and colloids.

Molecular dynamics simulations of the interactions between TiO_2 nanoparticles and water with Na^+ and Cl^−, methanol, and formic acid using a reactive force field

A. V. van Duin, Sung-Yup Kim, J. Kubicki, 2013 .

Atomistic investigation on initiation of stress corrosion cracking of polycrystalline Ni60Cr30Fe10 alloys under high-temperature water by reactive molecular dynamics simulation

Xiaolong Liu, Seung Hwan Lee, Sung-Yup Kim, 2021 .

Molecular Dynamics of The Early Stages of High Temperature Corrosion

Sung-Yup Kim, C. Taylor, 2021, Physical Review Materials.

Simulation of titanium metal/titanium dioxide etching with chlorine and hydrogen chloride gases using the ReaxFF reactive force field.

A. V. van Duin, Sung-Yup Kim, 2013, The journal of physical chemistry. A.

Atomic Insight into the Lithium Storage and Diffusion Mechanism of SiO2/Al2O3 Electrodes of Lithium Ion Batteries: ReaxFF Reactive Force Field Modeling.

E. D. Cubuk, A. V. van Duin, Y. Qi, 2016, The journal of physical chemistry. A.

Activity, Selectivity, and Durability of Ruthenium Nanoparticle Catalysts for Ammonia Synthesis by Reactive Molecular Dynamics Simulation: The Size Effect.

S. Han, Sung-Yup Kim, Hong Woo Lee, 2018, ACS applied materials & interfaces.

Development of a ReaxFF reactive force field for titanium dioxide/water systems.

A. V. van Duin, Sung-Yup Kim, Nitin Kumar, 2013, Langmuir : the ACS journal of surfaces and colloids.

Simulation of titanium metal/titanium dioxide etching with chlorine and hydrogen chloride gases using the ReaxFF reactive force field.

A. V. van Duin, Sung-Yup Kim, 2013, The journal of physical chemistry. A.