Journal of Computational and Theoretical Nanoscience

A Special Issue on Multiscale and Multiphysics Simulations for Energy Applications
pp. 801-802(2)
Authors: Jiang, Hanqing; Liu, Bin; Guo, Xu

Incorporation of Hydrogen Molecules into Carbon Nitride Heterofullerenes: An Ab Initio Study
pp. 803-807(5)
Authors: Javan, M. Bezi; Ganji, M. D.; Sabet, M.; Danesh, N.

Investigation of Charge Transfer and Excited State Nature of Two Isophorone Dyes
pp. 808-813(6)
Authors: Li, Yuanzuo; Li, Huixing; Zhang, Wenqin; Zhao, Xiaohong; Chen, Maodu; Ma, Fengcai

Boundary Condition and Strain Effects on the Quality Factors of Single Walled Carbon Nanotubes
pp. 814-819(6)
Authors: Kim, Sung Youb; Park, Harold S.

A Computational Study on the Transversal Visco-Elastic Properties of Single Walled Carbon Nanotubes and Their Relation to the Damping Mechanism
pp. 820-830(11)
Authors: Zhou, Zhong; Qian, Dong; Yu, Min-Feng

Simulated Raman Spectra of Small C_aY_b^{0, ±} (a ≤ 2; b ≤ 2a + 2; Y=H, D, T) Hydrocarbons in the Fusion Devices
pp. 831-841(11)
Authors: Jiang, Xue; Xu, Jingcheng; Zhao, Jijun

A State-Dependent Hysteresis Model for Giant Magnetostrictive Materials
pp. 842-846(5)
Authors: Gao, Xu; Pei, Yongmao; Fang, Daining

Optimal Parameters Assessment of Proton Exchange Membrane Fuel Cell on Module-Robot
pp. 847-852(6)
Author: Pa, P. S.

Hydrogenation of Carbon Nanotubes: Roles of Symmetry and Strain
pp. 853-857(5)
Authors: Xue, Kun; Xu, Zhiping

First-Principles Study on Alloying Effect on the Migration Barrier of He in Titanium Ditritide
pp. 858-861(4)
Authors: Wu, Y. X.; Liu, X.; Yin, X. H.; Ma, X. F.; Zhang, Qian-Feng

First-Principles Investigations on the Feasibility of the Boron Nitride Fullerene-Like B₃₆N₃₆ for Natural Gas Storage
pp. 862-866(5)
Authors: Ganji, M. D.; Ghorbanzadeh, M.; Negaresh, M.; Najafi, A. A.; Rezvani, M.; Shokry, M.

Critical Thickness and the Size-Dependent Curie Temperature of BaTiO₃ Nanofilms
pp. 867-872(6)
Authors: Zhang, Yihui; Sang, Yongliang; Liu, Bin; Fang, Daining

Multiscale Modeling of the Interfacial Fracture Behavior in the Sn–Cu₆ Sn₅–Cu System
pp. 873-880(8)
Authors: Fei, Huiyang; Yazzie, Kyle; Williams, Jason; Chawla, Nikhilesh; Jiang, Hanqing

Energy Dissipation of Nanoporous MFI Zeolite Under Dynamic Crushing
pp. 881-886(6)
Authors: Xu, Baoxing; Liu, Ling; Zhou, Qulan; Qiao, Yu; Xu, Jun; Li, Yibing; Tak, Mooho; Park, Taehyo; Chen, Xi