Polarizable continuum model

Theoretical Studies of Plasmonics using Electronic Structure Methods

(2011) Seth M. Morton et al.   CHEMICAL REVIEWS

Modeling solvent effects on chiroptical properties

(2011) Benedetta Mennucci et al.   CHIRALITY

Polarity-Sensitive Fluorescent Probes in Lipid Bilayers: Bridging Spectroscopic Behavior and Microenvironment Properties

(2011) Giulia Parisio et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Surface-Enhanced Fluorescence within a Metal Nanoparticle Array: The Role of Solvent and Plasmon Couplings

(2011) Ángel Sánchez-González et al.   Journal of Physical Chemistry C

Practical computation of electronic excitation in solution: vertical excitation model

(2011) Aleksandr V. Marenich et al.   Chemical Science

Selected features of the polarizable continuum model for the representation of solvation

(2011) Jacopo Tomasi   Wiley Interdisciplinary Reviews-Computational Molecular Science

The COSMO and COSMO-RS solvation models

(2011) Andreas Klamt   Wiley Interdisciplinary Reviews-Computational Molecular Science

Cavity field effects within a polarizable continuum model of solvation: Application to the calculation of electronic circular dichroism spectra of R-(+)-3-methyl-cyclopentanone

(2010) Silvio Pipolo et al.   INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY

A variational formulation of the polarizable continuum model

(2010) Filippo Lipparini et al.   JOURNAL OF CHEMICAL PHYSICS

Continuous surface charge polarizable continuum models of solvation. I. General formalism

(2010) Giovanni Scalmani et al.   JOURNAL OF CHEMICAL PHYSICS

Sorting Out the Relative Contributions of Electrostatic Polarization, Dispersion, and Hydrogen Bonding to Solvatochromic Shifts on Vertical Electronic Excitation Energies

(2010) Aleksandr V. Marenich et al.   Journal of Chemical Theory and Computation

Solute Partitioning into Lipid Bilayers: An Implicit Model for Nonuniform and Ordered Environment

(2010) Giulia Parisio et al.   Journal of Chemical Theory and Computation

Toward a General Formulation of Dispersion Effects for Solvation Continuum Models

(2010) Ville Weijo et al.   Journal of Chemical Theory and Computation

What is Solvatochromism?

(2010) Alberto Marini et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Continuum Solvation Models: What Else Can We Learn from Them?

(2010) Benedetta Mennucci   Journal of Physical Chemistry Letters

Fluorene Analogues of Prodan with Superior Fluorescence Brightness and Solvatochromism

(2010) Oleksandr A. Kucherak et al.   Journal of Physical Chemistry Letters

Laurdan Spectrum Decomposition as a Tool for the Analysis of Surface Bilayer Structure and Polarity: a Study with DMPG, Peptides and Cholesterol

(2009) Aline D. Lúcio et al.   JOURNAL OF FLUORESCENCE

Fluorescence Enhancement of Chromophores Close to Metal Nanoparticles. Optimal Setup Revealed by the Polarizable Continuum Model

(2009) Sinisa Vukovic et al.   Journal of Physical Chemistry C

Non covalent interactions in RNA and DNA base pairs: a quantum-mechanical study of the coupling between solvent and electronic density

(2009) Filippo Lipparini et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Quantum Mechanical Computations and Spectroscopy: From Small Rigid Molecules in the Gas Phase to Large Flexible Molecules in Solution

(2008) Vincenzo Barone et al.   ACCOUNTS OF CHEMICAL RESEARCH

Electronic structure methods for studying surface-enhanced Raman scattering

(2008) Lasse Jensen et al.   CHEMICAL SOCIETY REVIEWS