国家/地区 China（5）
关键词 MOLECULAR SIMULATION（7）
出版物
出版时间 2015（7）
机构 NANJING TECH.（4）
作者 YANG XN（4） YANG XP（2）

Pyridinic nitrogen doped nanoporous graphene as desalination membrane: Molecular simulation study

JOURNAL OF MEMBRANE SCIENCE

CHEN Q, YANG XN

Molecular dynamics simulation of water transport through graphene-based nanopores: Flow behavior and structure characteristics

CHINESE JOURNAL OF CHEMICAL ENGINEERING

YANG XP, YANG XN, LIU SY

Molecular simulation perspective of liquid-phase exfoliation, dispersion, and stabilization for graphene

CURRENT OPINION IN COLLOID INTERFACE SCIENCE

YANG J, YANG XN, LI YP

Molecular Dynamics Simulation of Water Molecules in Confined Slit Pores of Graphene

ACTA PHYSICOCHIMICA SINICA

ZHAO MY, YANG XP, YANG XN

Elucidating Adsorption Mechanisms of Phthalate Esters upon Carbon Nanotubes/Graphene and Natural Organic Acid Competitive Effects in Water by DFT and MD Calculations

BULLETIN OF THE KOREAN CHEMICAL SOCIETY

WANG Z, WANG S, CHEN MD, XU DF, TANG LL, WANG DG

Molecular dynamics simulation of trihalomethanes separation from water by functionalized nanoporous graphene under induced pressure

CHEMICAL ENGINEERING SCIENCE

AZAMAT J, KHATAEE A, JOOB SW

Insights into carbon nanotube and graphene formation mechanisms from molecular simulations: a review

REPORTS ON PROGRESS IN PHYSICS

PAGE AJ, DING F, IRLE S, MOROKUMA K