丙烯腈在Cu(100)表面化学吸附的密度泛函理论研究

夏树伟,高林娜,徐香,孙雅丽,夏少武

DFT Study of the Chemisorption of Acrylonitrile on the Cu(100) Surface

XIA Shu-Wei* ^,1, GAO Lin-Na, XU Xiang, SUN Ya-Li, XIA Shao-Wu ²

化学学报 . 2006, (1): 27 -31 .