XAupH3相关论文
采用量子化学ab initio HF和DFT B3LYP方法, 在考虑赝势双-ζ的LANL2DZ基组水平上对XAuPH3 (X = H, F, Cl, Br, I, CN, CH3)分别进......
The studies on model systems XAuPH3 (X=H, F, Cl, Br, I, CN, CH3 ) have been carried out by using ab intio HF and DFT B3L......
