The grand canonical Monte Carlo method is used to adsorption of benzene molecules in single walled carbon nanotubes(SWNT) in triangle array of different diameter(0.9nm, .nm, .89nm, .77nm).
The grand canonical Monte Carlo method is used to adsorption of benzene molecules in single walled carbon nanotubes(SWNT) in triangle array of different diameter(0.9nm, .nm, .89nm, .77nm).
对三角形排列的准一维介孔材料进行了系列的模拟研究,分别在四种孔径条件下(0.9nm, .nm, .89nm, .77nm),在 00K,00kPa的条件下,研究了纳米碳管对内部流体(苯)的限制作用。