- About
- Selected Publications
Assistant Professor, Department of Chemistry, University of Kansas
Research Scientist, Gaussian Inc. (2010-2014)
Post Doc., Yale University
Ph.D., Chemistry, Scuola Normale Superiore of Pisa (Italy)
M.Sc., Chemistry, Università di Pisa (Italy)
Contributions to Gaussian: Coupled cluster methods for ground and excited states. Development and application of Polarizable Continuum Model (PCM) of solvation for post-SCF methods.
Research Interests
- Continuum Solvation Models for time-dependent solvation
- Excited State properties in solution
- Coupled-Cluster Theory
- QM/QM methods (ONIOM) for excited state energies and properties
- Caricato M., “Exploring Potential Energy Surfaces of Electronic Excited States in Solution with the EOM-CCSD-PCM Method”, J. Chem. Theor. Comput. 8 (2012) 5081.
- Caricato, M., “CCSD-PCM: Improving upon the reference reaction field approximation at no cost” J. Chem. Phys. 135 (2011) 074113.
- Caricato, M., Scalmani, G., Frisch, M. J., “Brueckner doubles coupled cluster method with the polarizable continuum model of solvation” J. Chem. Phys. 134 (2011) 244113.
- Caricato, M., Vreven, T., Trucks, G. W., Frisch, M. J., “Oscillator Strengths in ONIOM Excited State Calculations”, J. Chem. Theor. Comput. 7 (2011) 180.
- Caricato, M., Mennucci, B., Scalmani, G., Trucks, G. W., Frisch, M. J., “Electronic excitation energies in solution at equation of motion CCSD level within a state specific polarizable continuum model approach”, J. Chem. Phys. 132 (2010) 084102.
- Caricato, M., Trucks, G. W., Frisch, M. J., Wiberg, K. B., “Electronic Transition Energies: A Study of the Performance of a Large Range of Single Reference Density Functional and Wave Function Methods on Valence and Rydberg States Compared to Experiment”, J. Chem. Theor. Comput. 6(2010) 370.
Last update: 10 August 2016
