10楼: Originally posted by fyh987 at 2012-02-25 15:33:01:
请问楼主是如何加真空层的

11楼: Originally posted by 沧海扶摇 at 2012-02-25 21:47:15:
在build中的crstal中选中“创建真空层”

12楼: Originally posted by liliangfang at 2012-02-26 08:56:06:
MS可以直接加，vasp要调整比例和原子位置

9楼: Originally posted by vallen at 2011-11-06 23:24:13
加到30埃试试...

2楼: Originally posted by utdwang at 2011-11-05 05:05:11
To avoid any interactions between bottom and top surfaces, you have to add a vacuum with a thickness of around 10 A.