CORC

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The Nature of the Fourth Bond in the Ground State of C-2 : The Quadruple Bond Conundrum 期刊论文
http://dx.doi.org/10.1002/chem.201400356, 2014
Danovich, David; Hiberty, Philippe C.; Wu, Wei; Rzepa, Henry S.; Shaik, Sason; 吴玮
收藏  |  浏览/下载:5/0  |  提交时间:2015/07/22
The V state of ethylene: valence bond theory takes up the challenge 期刊论文
http://dx.doi.org/10.1007/s00214-013-1441-x, 2014
Wu, Wei; Zhang, Huaiyu; Braida, Benoit; Shaik, Sason; Hiberty, Philippe C.; 吴玮
收藏  |  浏览/下载:15/0  |  提交时间:2015/07/22
Charge-Shift Bonding Emerges as a Distinct Electron-Pair Bonding Family from Both Valence Bond and Molecular Orbital Theories 期刊论文
http://dx.doi.org/10.1021/ct500367s, 2014
Zhang, Huaiyu; Danovich, David; Wu, Wei; Braida, Benoit; Hiberty, Philippe C.; Shaik, Sason; 吴玮
收藏  |  浏览/下载:4/0  |  提交时间:2015/07/22
北极经济再发现下的国际合作状况研究 期刊论文
2011
张侠; ZHANG Xia; 屠景芳; TU Jingfang
收藏  |  浏览/下载:6/0  |  提交时间:2014/04/04
Classical Valence Bond Approach by Modern Methods 期刊论文
2011
Wu, Wei; 吴玮; Su, Peifeng; Shaik, Sason(Hebrew Univ Jerusalem, Lise Meitner Minerva Ctr Computat Quantum Chem); Hiberty, Philippe C.(Univ Paris 11, Lab Chim Phys)
收藏  |  浏览/下载:2/0  |  提交时间:2012/02/21
Bonding Conundrums in the C-2 Molecule: A Valence Bond Study 期刊论文
http://dx.doi.org/10.1021/ct100577v, 2011
Su, PF; Wu, JF; Gu, JJ; Wu, W; Shaik, S; Hiberty, PC; 吴玮
收藏  |  浏览/下载:4/0  |  提交时间:2013/12/12
Multiple Low-Lying States for Compound I of P450(cam) and Chloroperoxidase Revealed from Multireference Ab Initio QM/MM Calculations 期刊论文
2010
Chen, Hui(Hebrew Univ Jerusalem, Inst Chem); Song, Jinshuai(Hebrew Univ Jerusalem, Inst Chem); Lai, Wenzhen(Hebrew Univ Jerusalem, Inst Chem); Wu, Wei; 吴玮; Shaik, Sason(Hebrew Univ Jerusalem, Inst Chem)
收藏  |  浏览/下载:2/0  |  提交时间:2011/04/26
An Excursion from Normal to Inverted C-C Bonds Shows a Clear Demarcation between Covalent and Charge-Shift C-C Bonds 期刊论文
2009
Shaik, Sason(Hebrew Univ Jerusalem, Inst Chem); Chen, Zhenhua; Wu, Wei; 吴玮; Stanger, Amnon(Technion Israel Inst Technol, Schulich Fac Chem); Danovich, David(Hebrew Univ Jerusalem, Inst Chem); Hiberty, Philippe C.(Univ Paris 11, Grp Chim Theor)
收藏  |  浏览/下载:30/0  |  提交时间:2011/04/26
Valence Bond Perturbation Theory. A Valence Bond Method That Incorporates Perturbation Theory 期刊论文
2009
Chen, Zhenhua; Song, Jinshuai; Shaik, Sason(Hebrew Univ Jerusalem, Inst Chem); Hiberty, Philippe C.(Univ Paris 11, CNRS); Wu, Wei; 吴玮
收藏  |  浏览/下载:1/0  |  提交时间:2011/04/26
Topology of Electron Charge Density for Chemical Bonds from Valence Bond Theory: A Probe of Bonding Types 期刊论文
2009
Zhang, Lixian; Ying, Fuming; Wu, Wei; 吴玮; Hiberty, Philippe C.(Univ Paris 11, Grp Chim Theor); Shaik, Sason(Hebrew Univ Jerusalem, Lise Meitner Minerva Ctr Computat Quantum)
收藏  |  浏览/下载:2/0  |  提交时间:2011/04/26


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