Solvated potential energy surfaces for MePC
Author:
Publisher
Springer Science and Business Media LLC
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics
Link
http://link.springer.com/content/pdf/10.1007/s11224-011-9775-2.pdf
Reference26 articles.
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3. Miertus S, Scrocco E, Tomasi J (1981) Electrostatic interaction of a solute with a continuum—a direct utilization of ab initio molecular potentials for the prevision of solvent effects. Chem Phys 55:117–129
4. Cancés E, Mennucci B, Tomasi J (1997) A new integral equation formalism for the polarizable continuum model: theoretical background and applications to isotropic and anisotropic dielectrics. J Phys Chem 107:3032–3041
5. Silva CO, Nascimento MAC (2004) Ab initio conformational maps in the gas phase and aqueous solution for a prototype of the glycosidic linkage. Theor Chem Acc 112:342–348
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1. Interplay of thermochemistry and Structural Chemistry, the journal (volume 22, 2011, issues 4–6) and the discipline;Structural Chemistry;2012-05-30
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