Standout Papers

Quantum Mechanical Continuum Solvation Models 1997 2026 2006 2016 14.1k
  1. Quantum Mechanical Continuum Solvation Models (2005)
    Jacopo Tomasi, Benedetta Mennucci et al. Chemical Reviews
  2. A new integral equation formalism for the polarizable continuum model: Theoretical background and applications to isotropic and anisotropic dielectrics (1997)
    Éric Cancès, Benedetta Mennucci et al. The Journal of Chemical Physics
  3. Continuum solvation models: A new approach to the problem of solute’s charge distribution and cavity boundaries (1997)
    Benedetta Mennucci, Jacopo Tomasi The Journal of Chemical Physics
  4. The IEF version of the PCM solvation method: an overview of a new method addressed to study molecular solutes at the QM ab initio level (1999)
    J. Tomasi, Benedetta Mennucci et al. Journal of Molecular Structure THEOCHEM
  5. Evaluation of Solvent Effects in Isotropic and Anisotropic Dielectrics and in Ionic Solutions with a Unified Integral Equation Method:  Theoretical Bases, Computational Implementation, and Numerical Applications (1997)
    Benedetta Mennucci, Éric Cancès et al. The Journal of Physical Chemistry B
  6. Definition of the hydrogen bond (IUPAC Recommendations 2011) (2011)
    E. Arunan, Gautam R. Desiraju et al. Pure and Applied Chemistry
  7. Ab initio study of ionic solutions by a polarizable continuum dielectric model (1998)
    Maurizio Cossi, Vincenzo Barone et al. Chemical Physics Letters
  8. Geometries and properties of excited states in the gas phase and in solution: Theory and application of a time-dependent density functional theory polarizable continuum model (2006)
    Giovanni Scalmani, Michael J. Frisch et al. The Journal of Chemical Physics
  9. Defining the hydrogen bond: An account (IUPAC Technical Report) (2011)
    E. Arunan, Gautam R. Desiraju et al. Pure and Applied Chemistry
  10. Polarizable continuum model (2012)
    Benedetta Mennucci Wiley Interdisciplinary Reviews Computational Molecular Science
  11. Polarizable Continuum Model (PCM) Calculations of Solvent Effects on Optical Rotations of Chiral Molecules (2002)
    Benedetta Mennucci, J. Tomasi et al. The Journal of Physical Chemistry A
  12. Fast Evaluation of Geometries and Properties of Excited Molecules in Solution:  A Tamm-Dancoff Model with Application to 4-Dimethylaminobenzonitrile (2000)
    Roberto Cammi, Benedetta Mennucci et al. The Journal of Physical Chemistry A
  13. Formation and relaxation of excited states in solution: A new time dependent polarizable continuum model based on time dependent density functional theory (2006)
    Marco Caricato, Benedetta Mennucci et al. The Journal of Chemical Physics
  14. What is Solvatochromism? (2010)
    Alberto Marini, Aurora Muñoz‐Losa et al. The Journal of Physical Chemistry B
  15. TD-DFT Assessment of Functionals for Optical 0–0 Transitions in Solvated Dyes (2012)
    Denis Jacquemin, Aurélien Planchat et al. Journal of Chemical Theory and Computation
  16. On the Metric of Charge Transfer Molecular Excitations: A Simple Chemical Descriptor (2013)
    Ciro A. Guido, Pietro Cortona et al. Journal of Chemical Theory and Computation

Immediate Impact

3 by Nobel laureates 5 from Science/Nature 128 standout
Sub-graph 1 of 17

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106 intermediate papers

Works of Benedetta Mennucci being referenced

Quantum Mechanical Continuum Solvation Models
2005 Standout
A new integral equation formalism for the polarizable continuum model: Theoretical background and applications to isotropic and anisotropic dielectrics
1997 Standout
and 65 more

Author Peers

Author Last Decade Papers Cites
Benedetta Mennucci 16471 15598 9150 18887 347 51.1k
Jacopo Tomasi 11323 11202 5904 17667 190 39.9k
Mark S. Gordon 24974 11007 5396 16156 555 53.5k
Walter Thiel 15085 7652 9344 15188 719 45.3k
Warren J. Hehre 21691 12650 5789 25455 211 61.0k
Michael J. Frisch 30723 17521 9325 28075 275 80.3k
Keiji Morokuma 17900 7818 7114 17928 828 49.5k
Michael J. S. Dewar 11566 9920 5393 21089 490 41.0k
Carlo Adamo 12926 11100 2794 12974 454 43.7k
H. Bernhard Schlegel 18561 7557 4610 17663 443 45.2k
Martin Head‐Gordon 42670 16449 5602 14762 673 76.1k

All Works

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2026