Maurizio Cossi - researchr alias

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Viewing Publication 1 - 7 from 7

2005

Building cavities in a fluid of spherical or rod-like particles: A contribution to the solvation free energy in isotropic and anisotropic polarizable continuum modelCaterina Benzi, Maurizio Cossi, Roberto Improta, Vincenzo Barone. jcc, 26(11):1096-1105, 2005. [doi]

2003

Energies, structures, and electronic properties of molecules in solution with the C-PCM solvation modelMaurizio Cossi, Nadia Rega, Giovanni Scalmani, Vincenzo Barone. jcc, 24(6):669-681, 2003. [doi]

1999

Effective generation of molecular cavities in polarizable continuum model by DefPol procedureChristian Silvio Pomelli, Jacopo Tomasi, Maurizio Cossi, Vincenzo Barone. jcc, 20(16):1693-1701, 1999. [doi]

Improving performance of polarizable continuum model for study of large molecules in solutionNadia Rega, Maurizio Cossi, Vincenzo Barone. jcc, 20(11):1186-1198, 1999. [doi]

1998

Geometry optimization of molecular structures in solution by the polarizable continuum modelVincenzo Barone, Maurizio Cossi, Jacopo Tomasi. jcc, 19(4):404-417, 1998. [doi]

Correction of cavity-induced errors in polarization charges of continuum solvation modelsMaurizio Cossi, Benedetta Mennucci, Jesús Pitarch, Jacopo Tomasi. jcc, 19(8):833-846, 1998. [doi]

1996

Analytical first derivatives of molecular surfaces with respect to nuclear coordinatesMaurizio Cossi, Benedetta Mennucci, Roberto Cammi. jcc, 17(1):57-73, 1996. [doi]

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