2016
David McDonald, Daniel Mauney, Daniel Leicht, Joshua Marks, Jake Tan, Jer-Lai Kuo, and Michael Duncan
Trapping a Proton in Argon: Spectroscopy and Theory of the Proton-bound Argon Dimer and its Solvation
J. Chem. Phys., 145, 231101 (2016) link
Po-Jen Hsu, Kun-Lin Ho, Sheng-Hsien Lin and Jer-Lai Kuo
Exploration of hydrogen bond networks and potential energy surfaces of methanol clusters with a two-stage clustering algorithm
Phys. Chem. Chem. Phys., (accepted) link
Takuto Shimamori, Jer-Lai Kuo and Asuka Fujii
Stepwise Internal Energy Control of Protonated Methanol Clusters by Using the Inert Gas Tagging
J. Phys. Chem. A, 120, 9203–9208 (2016) link
Jake A. Tan, Jheng-Wei Li, Cheng-chau Chiu, Hai Thi Huynh, Hsin-Yi Liao and Jer-Lai Kuo
Tuning the Vibrational Coupling of H3O+ by Changing Its Solvation Environment
Phys. Chem. Chem. Phys., 18, 30721–30732 (2016) link
Kun-Lin Ho, Lo-Yun Lee, Marusu Katada, Asuka Fujii, and Jer-Lai Kuo
An Ab-Initio Anharmonic Approach to Study Vibrational Spectra of Small Ammonia Clusters
Phys. Chem. Chem. Phys., 18, 30498–30506 (2016) link
Amol Deshmukh, Cheng-chau Chiu, Yun-Wen Chen, and Jer-Lai Kuo
Tunable Gravimetric and Volumetric Hydrogen Storage Capacities in Polyhedral Oligomeric Silsesquioxane Frameworks
ACS App. Mater. Interfaces, 8, 25219–25228 (2016) link
Ang-Yu Lu, Xiulin Yang, Chien-Chih Tseng, Shixiong Min, Shi-Hsin Lin, Chang-Lung Hsu, Henan Li, Hicham Idriss, Jer-Lai Kuo, Kuo-Wei Huang and, Lain-Jong Li
High-Sulfur-Vacancy Amorphous Molybdenum Sulfide as a High Current Electrocatalyst in Hydrogen Evolution
Small, 40, 5530–5537 (2016) link
Darwin B. Putungan, Shi-Hsin Lin, and Jer-Lai Kuo
Metallic VS2 monolayer polytypes as potential Sodium ion battery anode via ab-initio random structure searching
ACS App. Mater. Interfaces, 8, 18754–18762 (2016) link
Jake A. Tan and Jer-Lai Kuo
A Closer Examination on the Coupling between Ionic Hydrogen Bond (IHB) Stretch and Flanking Group motions in (CH3OH)2H+: The Strong Isotope Effects
Phys. Chem. Chem. Phys., 18, 14531-14542 (2016) link
Piin-Ruey Pan, En-Ping Lu, Jer-Lai Kuo and Ming-Kang Tsai
The Spectroscopic Features of Ionized Water Medium: Theoretical Characterization and Implication Using (H2O)n+, n=3–4,Cluster Model
J. Chin. Chem. Soc., 62, 488–498 (2016) link
Jake A. Tan and Jer-Lai Kuo
Why is the “donor-acceptor” stretching a sine qua non in understanding the vibrational signatures of ionic hydrogen bonds?
Progress of Theoretical Chemistry and Physics: Quantum Systems in Physics,Chemistry, and Biology: Selected Proceedings of QSCP-XX, (accepted)
Xiaofeng Fan, W. T. Zheng, Jer-Lai Kuo, David J. Singh, C.Q. Sun and W. Zhu
Modulation of electronic properties from stacking orders and spin-orbit coupling for 3R-type MoS2
Sci. Rep., 6, 24140 (2016) link
Jiaxu Yan, Chao Li, Da Zhan, Lei Liu, Dezhen Shen, Jer-Lai Kuo, Shoushun Chen and Zexiang Shen
Graphene Homojunction: Closed-edge Bilayer Graphene by Pseudospin Interaction
Nanoscale, 8, 9102 (2016) link
Tzu-Jen Lin, Cheng-Rong Hsing, Ching-Ming Wei and Jer-Lai Kuo
Structure Prediction of the Solid Forms of Methanol: An Ab Initio Random Structure Searching Approach
Phys. Chem. Chem. Phys., 18, 2736 (2016) link