The Lab of Molecular and Materials Simulation
Introduction   Group Members   Research   Publications   Contact

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  1. J. Lan, D. Cheng, Dapeng Cao*, W. Wang, Silicon nanotubes as a promising candidate for hydrogen storage: From first-principle calculation to GCMC simulations, Journal of Physical Chemistry C, 2008, 112, 5598.

            

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Also reported by: American Chemical Society's Weekly PressPac; Science Daily; Nanowerk Spotlight; Nanowerk News; Daily Tech; Hydrogen Fuel; Controlled Environment Magazine; Nanotechwire.com; Science Behind Things; Physorg.com; Computer Juice; Nanotechnology Now; Silobreaker; Russ News; Evworld News; Wikio Hersem News; NanoChina

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  1. Dapeng Cao and J. Wu, Molecular simulation of novel carbonaceous materials for hydrogen storage, Nano Letters, 2004, 4(8), 1489-1492. Also Highlighted in DOE (USA) report: Opportunities for Discovery: Theory and Computation in Basic Energy Sciences (January 2005).

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  1. L. Cheng, Dapeng Cao*, Understanding self-assembly of rod-coil copolymer in nanoslits, Journal of Chemical Physics, 2008, 128, 074902. Also appeared in Virtual Journal of Nanoscale Science & Technology (March 3, 2008)

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CopyRight(C): The Lab of Molecular and Materials Simulation, BUCT.

Contact: chengdaojian@gmail.com

The Lab of Molecular and Materials Simulation is a division of The Key Lab for Nanomaterials, The Ministry of Education of China, Beijing University of Chemical Technology. The main research interests include adsorption properties of porous nanomaterials, development of force field of ionic liquids, structure and catalysis properties of metallic nanoclusters, self-assembly of polymers with complex architecture and transport behavior of fluids in nanomembrane.

Mailing Address and Contact Persons:

Director: Professor Wenchuan Wang
College of chemical engineering
Beijing University of Chemical Technology
Beijing 100029, China

Tel: +86-10-64427616; +86-10-64444905
Fax: +86-10-64427616
E-mail: wangwc@mail.buct.edu.cn; wangwc@163bj.com

Vice Director: Professor Dapeng Cao
College of Chemical Engineering
Beijing University of Chemical Technology
Beijing 100029, China

Tel: +86-10-64443254 Fax: +86-10-64427616
Email: caodp@mail.buct.edu.cn; cao_dp@hotmail.com

Group Members:

Faculty:

Wenchuan Wang, Professor and Director of the Lab.

Dapeng Cao £¨²Ü´ïÅô£© Professor and Vice Director of the Lab.

Ph. D. in Chemical Engineering (Beijing University of Chemical Technology), Postdoctoral Fellow: University of California, Riverside, USA.

Shiping Huang, Professor

Ph. D. in Physical Chemistry ( the Institute of Metallurgy of the Chinese Academy of Sciences, Shanghai, China). Postdoctoral Fellow: New Mexico University and South Caloralla State University, USA.

Xianren Zhang, Professor

Ph. D. in chemical engineering ( Beijing University of Chemical Technology), Postdoctoral Fellow: Beijng University of Chemical Technology, and Ecole Normale Sup¨¦rieure de Lyon (ENS-Lyon, France)

Zhiping Liu, Associate Professor

Ph D. in chemical engineering ( Tsinghua University, Beijing, China) Postdoctoral Fellow: Beijing University of Chemical Technology.

Weixia Tu, Associate Professor

Ph. D. in Chemistry ( Institute of Chemistry, Chinese Academy of Sciences, Beijing), Postdoctoral Fellow: Tokyo Institute of Technology.

Xiaohong Shao, Associate Professor

Ms. in Physics (The Institute of High Energy Physics, of the Chinese Academy of Sciences, Beijing, China), Ph. D. in chemical engineering ( Beijing University of Chemical Technology).

Graduate students:
about 40 Ph. D. and Ms. Students currently with undergraduate background in chemical engineering, physics, mathematics and computer science.