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J

J. Tomasi

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Top Publications

Electrostatic interaction of a solute with a continuum. A direct utilizaion of AB initio molecular potentials for the prevision of solvent effects

Chemical Physics19818,798 citationsCorresponding

A new integral equation formalism for the polarizable continuum model: Theoretical background and applications to isotropic and anisotropic dielectrics

The Journal of Chemical Physics19976,747 citations

Approximate evaluations of the electrostatic free energy and internal energy changes in solution processes

Chemical Physics19822,455 citations

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

The Journal of Physical Chemistry B19972,138 citations

Remarks on the use of the apparent surface charges (ASC) methods in solvation problems: Iterative versus matrix‐inversion procedures and the renormalization of the apparent charges

Journal of Computational Chemistry19951,401 citations

Polarizable Continuum Model (PCM) Calculations of Solvent Effects on Optical Rotations of Chiral Molecules

The Journal of Physical Chemistry A2002741 citations

J. Tomasi · Scinovex