Jer-Lai Kuo

发表

Finding multiple first order saddle points using a valley adaptive clearing genetic algorithm

Yew-Soon Ong, Meng-Hiot Lim, Mostafa Mostafa Hashim Ellabaan, 2009, 2009 IEEE International Symposium on Computational Intelligence in Robotics and Automation - (CIRA).

A LAMMPS implementation of volume-temperature replica exchange molecular dynamics

Jer-Lai Kuo, Liang-Chun Liu, 2015, Comput. Phys. Commun..

A Hierarchical Approach to Study the Thermal Behavior of Protonated Water Clusters H(+)(H2O)n.

Jer-Lai Kuo, Yew-Soon Ong, Quoc Chinh Nguyen, 2009, Journal of chemical theory and computation.

Memetic figure selection for cluster expansion in binary alloy systems

Zhen Ji, Zexuan Zhu, Jer-Lai Kuo, 2011, 2011 IEEE Workshop on Memetic Computing (MC).

Discovering Unique, Low-Energy Pure Water Isomers: Memetic Exploration, Optimization, and Landscape Analysis

Harold Soh, Yew-Soon Ong, Mohamed Salahuddin Habibullah, 2010, IEEE Transactions on Evolutionary Computation.

Graph invariants for periodic systems: towards predicting physical properties from the hydrogen bond topology of ice.

Jer-Lai Kuo, S. J. Singer, J. Kuo, 2003, Physical review. E, Statistical, nonlinear, and soft matter physics.

Recent advances in understanding the structures of medium-sized protonated water clusters

Jer-Lai Kuo, Huan-Cheng Chang, J. Kuo, 2005 .

Physisorption Structure of Water on the GaN Polar Surface: Force Field Development and Molecular Dynamics Simulations

Jer-Lai Kuo, J. Kuo, Osbert Zheng Tan, 2011 .

A direct first principles study on the structure and electronic properties of BexZn1−xO

Yueguang Lu, Yew-Soon Ong, Jer-Lai Kuo, 2007 .

Collision-induced dissociation of sodiated glucose and identification of anomeric configuration.

Chi-Kung Ni, Po-Jen Hsu, Jer-Lai Kuo, 2017, Physical chemistry chemical physics : PCCP.

EVOLUTIONARY DISCOVERY OF TRANSITION STATES IN WATER CLUSTERS

Yew-Soon Ong, Jer-Lai Kuo, Mostafa M Hashim Ellabaan, 2012 .

On the use of graph invariants for efficiently generating hydrogen bond topologies and predicting physical properties of water clusters and ice

Yehuda B. Band, Jer-Lai Kuo, James V. Coe, 2001 .

DFT Study of Hydrogen Storage by Spillover on Graphene with Boron Substitution

Hong-Yu Wu, Jer-Lai Kuo, Wei-Qiao Deng, 2011 .

Hydrogen-bond topology and the ice VII/VIII and ice Ih/XI proton-ordering phase transitions.

Jer-Lai Kuo, Michael L Klein, S. J. Singer, 2005, Physical review letters.

Structure of protonated water clusters: low-energy structures and finite temperature behavior.

Jer-Lai Kuo, Michael L Klein, M. Klein, 2005, The Journal of chemical physics.

Orbital analysis of electronic structure and phonon dispersion in MoS 2 , MoSe 2 , WS 2 , and WSe 2 monolayers under strain

Jer-Lai Kuo, Xiaofeng Fan, J. Kuo, 2013 .

Composition-temperature phase diagram of BexZn1−xO from first principles

Jer-Lai Kuo, Xiaofeng Fan, Chee Kwan Gan, 2010 .

Metallic VS2 Monolayer Polytypes as Potential Sodium-Ion Battery Anode via ab Initio Random Structure Searching.

Jer-Lai Kuo, J. Kuo, Shi-Hsin Lin, 2016, ACS applied materials & interfaces.

Theoretical Prediction of Anode Materials in Li-Ion Batteries on Layered Black and Blue Phosphorus

Jer-Lai Kuo, Chun-Gang Duan, J. Kuo, 2015 .

On the effects of basis-set in studying the hydration and dissociation of HF in cubic HF(H2O)7 clusters

Yew-Soon Ong, Jer-Lai Kuo, Zhi-Zhong Xie, 2008 .

Hydrogen bond topology and the ice VII/VIII and Ih/XI proton ordering phase transitions.

Jer-Lai Kuo, Michael L Klein, S. J. Singer, 2005, Physical review. E, Statistical, nonlinear, and soft matter physics.

Multiscale approach to explore the potential energy surface of water clusters (H2O)nn

Harold Soh, Jer-Lai Kuo, Yew Soon Ong, 2008, The journal of physical chemistry. A.

Dissociation of hydrogen fluoride in HF(H(2)O)(7).

Jer-Lai Kuo, Michael L Klein, 2004, The Journal of chemical physics.