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Mechanisms and reactivity differences for cycloaddition of anhydride to alkyne catalyzed by palladium and nickel catalysts: Insight from density functional calculations 期刊论文
http://dx.doi.org/10.1021/jo501618k, 2014
Xie, Hujun; Sun, Qiang; Ren, Gerui; Cao, Zexing; 曹泽星
收藏  |  浏览/下载：3/0  |  提交时间：2015/07/22
Spin-orbit coupling effect on Au-C-60 interaction: A density functional theory study 期刊论文
http://dx.doi.org/10.1016/j.chemphys.2011.06.013, 2012
Zeng, Qun; Chu, Xiang; Yang, Mingli; Wu, De-Yin; 吴德印
收藏  |  浏览/下载：3/0  |  提交时间：2015/07/22
Photoelectron Imaging and Theoretical Studies of Silver Monohalides AgX(-) (X = Cl, Br, I) and AuCl(-) 期刊论文
2011
Wu, Xia（Chinese Acad Sci, Dalian Inst Chem Phys）; Xie, Hua（Chinese Acad Sci, Dalian Inst Chem Phys）; Qin, Zhengbo（Chinese Acad Sci, Dalian Inst Chem Phys）; Tan, Kai; 谭凯; Tang, Zichao（Chinese Acad Sci, Dalian Inst Chem Phys）; Lu, Xin; 吕鑫
收藏  |  浏览/下载：1/0  |  提交时间：2012/03/04
Density functional theory study on the interaction of Pd-6 with multiple H-2 期刊论文
2004
Wang, YJ; Zhang, JL; Cao, ZX; Zhang, QR; 曹泽星
收藏  |  浏览/下载：2/0  |  提交时间：2013/12/12
Density functional theory study of structures and spectroscopic properties of Cu-n(-) and CunCO- (n=2-7) 期刊论文
2003
Wang, YJ; 王延金; Cao, ZX; 曹泽星; Zhang, QE; 张乾二
收藏  |  浏览/下载：1/0  |  提交时间：2012/04/27
Theoretical investigation of F-19 NMR chemical shielding of alkaline-earth-metal and alkali-metal fluorides 期刊论文
http://dx.doi.org/10.1021/jp013503f, 2002
Cai, S. H.; Chen, Z.; Wan, H. L.; 万惠霖
收藏  |  浏览/下载：1/0  |  提交时间：2013/12/12
Theoretical investigation of F-19 NMR chemical shielding of alkaline-earth-metal and alkali-metal fluorides 期刊论文
http://dx.doi.org/10.1021/jp013503f, 2002
Cai, S. H.; Chen, Z.; Wan, H. L.; 蔡淑惠
收藏  |  浏览/下载：3/0  |  提交时间：2013/12/12
Theoretical investigation of F-19 NMR chemical shielding of alkaline-earth-metal and alkali-metal fluorides 期刊论文
http://dx.doi.org/10.1021/jp013503f, 2002
Cai, S. H.; Chen, Z.; Wan, H. L.; 陈忠
收藏  |  浏览/下载：2/0  |  提交时间：2013/12/12
Ab initio calculation of F-19 NMR chemical shielding for alkaline-earth-metal fluorides 期刊论文
2001
Cai, S. H.; Chen, Z.; Lu, X.; Chen, Z. W.; Wan, H. L.; 万惠霖
收藏  |  浏览/下载：5/0  |  提交时间：2013/12/12
On bonding, structure, and stability of ternary hydrides A(2)MH(2) (A = Li, Na; M = Pd, Pt) 期刊论文
http://dx.doi.org/10.1002/(SICI)1521-3749(199809)624:9<1419::AID-ZAAC1419>3.0.CO;2-I, 1998
Liao, M. S.; Zhang, Q. E.; Schwarz, W. H. E.; 张乾二
收藏  |  浏览/下载：5/0  |  提交时间：2013/12/12

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