全部文献期刊学位论文会议报纸专利标准年鉴图书|学者科研项目
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作者:Jean-Marie Ducéré , Christine Lepetit , Remi Chauvin
来源:[J].J. Phys. Chem. C, 2013, Vol.117 (42), pp.21671鈥?1681ACS
摘要:In the linear regime of the Hooke’s law, the stress tensor σ is the product of the strain tensor ε with the elastic stiffness tensor referred to as C(1) ... It also summarizes how CVD diamond can be tailored for specific applications, on the basis of the ability to synthesiz...
作者:Christine Lepetit , Valérie Maraval ...
来源:[J].Coordination Chemistry Reviews(IF 11.016), 2016, Vol.308, pp.59-75Elsevier
摘要:Abstract(#br)Beyond the characterization of coordination bonding by various experimental or theoretical signatures, an energetic measure of the quantitative dative character of a bond is derived by extension of Haaland's definition of dative bonding with respect to pure (“sh...
作者:Christine Lepetit , Valérie Maraval ...
来源:[J].Coordination Chemistry Reviews(IF 11.016), 2016, Vol.308, pp.59-75Elsevier
摘要:Abstract(#br)Beyond the characterization of coordination bonding by various experimental or theoretical signatures, an energetic measure of the quantitative dative character of a bond is derived by extension of Haaland's definition of dative bonding with respect to pure (“sh...
作者:Christine Lepetit , Pierre Fau ...
来源:[J].Coordination Chemistry Reviews(IF 11.016), 2017, Vol.345, pp.150-181Elsevier
摘要:Abstract(#br)This contribution explains how the topological methods of analysis of the electron density and related functions such as the electron localization function (ELF) and the electron localizability indicator (ELI-D) enable the theoretical characterization of various...
作者:... Pascal G. Lacroix , Christine Lepetit , Keitaro Nakatani
来源:[J].Journal of Organometallic Chemistry(IF 2), 2014, Vol.769, pp.64-71Elsevier
摘要:Abstract(#br)The reaction of N , N -bis(2-hydroxy-4-R-benzylidene)-1,2-phenylendiimine ( 1 R = OH, 2 R = OMe) with R′ 2 SnO (R′ = Me, n -Bu, Ph) provided six new organotin derivatives: dimethyl-di- n -butyl- and diphenyl[ N , N ′-bis(3-hydroxysalicylaldehyde)-1,2-phenyl...
作者:Pascal G. Lacroix , Isabelle Malfant , Christine Lepetit
来源:[J].Coordination Chemistry Reviews(IF 11.016), 2016, Vol.308, pp.381-394Elsevier
摘要:Abstract(#br)Various inorganic and organometallic complexes exhibiting quadratic nonlinear optical (NLO) properties (i.e., linearly correlated to the square of the electric field E 2 ) are reviewed. The computational approaches available for the calculation at various levels...
作者:Pascal G. Lacroix , Isabelle Malfant , Christine Lepetit
来源:[J].Coordination Chemistry Reviews(IF 11.016), 2016, Vol.308, pp.381-394Elsevier
摘要:Abstract(#br)Various inorganic and organometallic complexes exhibiting quadratic nonlinear optical (NLO) properties (i.e., linearly correlated to the square of the electric field E 2 ) are reviewed. The computational approaches available for the calculation at various levels...
作者:... Boutheïna Kerkeni , Christine Lepetit , Dorothée Berthomieu
来源:[J].Journal of Molecular Modeling(IF 1.984), 2016, Vol.22 (12)Springer
摘要:Abstract(#br)A quantum chemistry study of mononuclear metal coordination with four 4-methylimidazole ligands (4-MeIm) was investigated. The four complexes [Cu(4-MeIm)4]2+, [Cu(4-MeIm)4, H2O]2+, [Zn(4-MeIm)4]...
作者:Christine Lepetit , Remi Chauvin
来源:[J].Phosphorus, Sulfur, and Silicon and the Related Elements(IF 0.601), 2009, Vol.184 (6), pp.1561-1572Taylor & Francis
摘要:The ring carbo-mer of silole, termed as carbo-silole, was investigated at the DFT level of theory (B3PW91/6-31G**) and compared to its carbo-cyclopentadiene and carbo-cyclopentadienone analogues. The electronic delocalization of these species and their parent molecules is an...
作者:Christine Lepetit , Leila Yahi ...
来源:[J].Phosphorus, Sulfur, and Silicon and the Related Elements(IF 0.601), 2009, Vol.184 (6), pp.1573-1585Taylor & Francis
摘要:Carbo-siloles could a priori be generated by eliminative aromatization of sila[5]pericyclyne precursors with adjacent C─OR and C─H vertices. The synthesis of tetraoxy-sila[5]pericyclyne representatives (“carbo-silolanes” 2a and 2b) has been tackled through several [(15-...

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