Molecular Simulation of Water and Hydration Effects in Different Environments: Challenges and Developments for DFTB Based Models

por Goyal, Puja, Qian, Hu-Jun, Irle, Stephan, Lu, Xiya, Roston, Daniel, Mori, Toshifumi, Elstner, Marcus, Cui, Qiang
Publicado 2014

Interfacial Properties and Hopping Diffusion of Small Nanoparticle in Polymer/Nanoparticle Composite with Attractive Interaction on Side Group

por Ren, Kai-Xin, Jia, Xiang-Meng, Jiao, Gui-Sheng, Chen, Tao, Qian, Hu-Jun, Lu, Zhong-Yuan
Publicado 2018

An unexpected N-dependence in the viscosity reduction in all-polymer nanocomposite

por Chen, Tao, Zhao, Huan-Yu, Shi, Rui, Lin, Wen-Feng, Jia, Xiang-Meng, Qian, Hu-Jun, Lu, Zhong-Yuan, Zhang, Xing-Xing, Li, Yan-Kai, Sun, Zhao-Yan
Publicado 2019