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44篇 您的检索式:作者名="B Mennucci"
    题名 作者 年代 出处 被引量
1Second-order Mller- plesset analytical derivatives for the polarizable continu- um model using the relaxed density approach 显示文摘Cammi R Mennucci B Tomasi J 1999J Phys Chem A1999,103,45:1
2显示文摘CANCES E MENNUCCI B TOMASI J 1997J Chem Phys1997,107,:1
3Analytical ftrst derivatives of molecular surfaces with respect to nuclear coordinates 显示文摘Cossi M Mennucci B 1996J Comput Chem1996,17,1:1
4A new integral equation formalism for the polarizable continuum model:Theoretical background and applications to isotropic and anisotropic dielectrics显示文摘CANCES E MENNUCCI B TOMASI J 1997J Chem Phys1997,107,8:1
5Ab initio study of ionic solutions by a polarizable continuum dielectric model显示文摘Cossi M Barone V Mennucci B 1998Chemical Physics Letters1998,286,34:1
6A new integral equation formalism for the polarizable continuum model:Theoretical background and applications to isotropic and anisotropic dielectrics显示文摘Cancès E Mennucci B Tomasi J 1997J Chem Phys1997,107,:1
7显示文摘CANC S E MENNUCCI B TOMASI J 1997J Chem Phys1997,107,:1
8Excited states and solvatochromic shifts within a nonequilibrium solvation approach: A new formulation of the integral equation formalism method at the self-consistent field, configuration interaction, and multiconfiguration self-consistent field level显示文摘Mennucci B Cammi R Tomasi J 1998J Chem Phys1998,109,7:1
9Quantum me?chanical continuum solvation models 显示文摘TOMASI J MENNUCCI B CAMMI R 2005Chern Rev2005,105,:1
10Quantum mechanical continuum solvationmodels 显示文摘Tomasi J Mennucci B Cammi R 2005Chem Rev2005,105,8:1
11查看详情显示文摘Tomasi J Mennucci B Cammi R 0,,8:1
12Quantum mechanical continuum solvation models 显示文摘Tomasi J Mennucci B Cammi R 2005Chemical Reviews2005,105,8:1
13Evaluation of solvent effects in isotzopic and anisotropic dielectrics and in ionic solutions with a unified integral equation method : theoretical bases, computational implementation, and numerical appli- cations 显示文摘Mennucci B Cances E Tomasi J 1997The Journal of Physical Chemistry B1997,101,10:1
14Quantum mechanical continuum solvation models显示文摘Tomasi J Mennucci B Cammi R 2005Chem Rev2005,105,8:1
15Ab ini- tio study of ionic solutions by a polarizable continuum dielectric model显示文摘COSSI M BARONE V MENNUCCI B 1998Chemical Physics Letters1998,286,34:1
16A new integral equation formalism for the polarizable contin- uum model: Theoretical background and applications to isotropic and anisotropic dielectrics显示文摘CANCIS M T MENNUCCI B TOMASI J 1997The Journal of Chemical Physics1997,107,8:1
17Ab initio study of ionic solutions by a polarizable continu- um dielectric model 显示文摘COSSI M BARONE V MENNUCCI B 1998Chemical Physics Letters1998,286,34:1
18Quantum mechanical continuum solvation models显示文摘Tomasi J Mennucci B Cammi R 0,,08:1
19A new integral equation formalism for the polarizable continuum model: Theoretical background and applications to isotropic and anisotropic dielectrics显示文摘Cances E Mennucci B Tomasi J 1997J Chem Phys1997,107,:1
20A new integral equation formalism for the polarizable continuum model : theoretical background and applications to isotropic and anisotropic dielectrics显示文摘CANCES M T MENNUCCI B TOMASI J 1997J Chem Phys1997,107,:1
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