COSSI, MAURIZIO
COSSI, MAURIZIO
DIPARTIMENTO DI CHIMICA (attivo dal 02/01/1993 al 31/12/2012)
Accurate prediction of electron-paramagnetic-resonance tensors for spin probes dissolved in liquid crystals
2005 Benzi, Caterina; Cossi, Maurizio; Barone, Vincenzo
Building cavities in a fluid or ord-like particles: a contribution to the salvation free energy in isotropic and anisotropic polarizable continuum method.
2005 Benzi, Caterina; Cossi, Maurizio; R., Improta; Barone, Vincenzo
Theoretical models of the interaction between organic molecules and semiconductor surfaces
2006 Cossi, Maurizio
Ab initio study of electron affinity variation induced by organic molecule adsorption on the silicon (001) surface
2007 Borriello, Ivo; Cantele, Giovanni; Ninno, Domenico; Iadonisi, Giuseppe; Cossi, Maurizio; Barone, Vincenzo
Accurate and effective calculation of amide proton magnetic shieldings in a calcium binding peptide
2004 Benzi, Caterina; Cossi, Maurizio; Barone, Vincenzo
CALCOLO TEORICO DEI PARAMETRI NMR DI MOLECOLE ORGANICHE E BIOLOGICHE
2002 Barone, Vincenzo; C., Benzi; Cossi, Maurizio; Crescenzi, Orlando
EFFECTIVE PROCEDURES FOR CALCULATING NMR PARAMETERS ON LARGE MOLECULAR SYSTEMS IN SOLUTION
2002 Barone, Vincenzo; C., Benzi; Cossi, Maurizio
CALCULATION OF SOLVENT EFFECTS ON THERMODYNAMIC, OPTICAL AND MAGNETIC PROPERTIES
2002 Cossi, Maurizio
EFFECTIVE PROCEDURES FOR CALCULATING NMR PARAMETERS ON LARGE MOLECULAR SYSTEMS IN SOLUTION
2002 Barone, Vincenzo; C., Benzi; Cossi, Maurizio
Continuum solvation model for infinite periodic systems
2004 Cossi, Maurizio
ACCURATE CALCULATION OF NUCLEAR MAGNETIC SHIELDINGS FOR LARGE MOLECULES IN VACUO AND IN SOLUTION
2002 Barone, Vincenzo; Cossi, Maurizio; Crescenzi, Orlando
CONTINUUM SOLVATION MODEL FOR INFINITE PERIODIC SYSTEMS
2003 Cossi, Maurizio
SPECTROSCOPY IN SOLUTION. CONTINUUM, DISCRETE AND MIXED MODELS
2003 Cossi, Maurizio
DICARBOXYLIC ACIDS ABSORBED ON GAAS SURFACES: CORRELATION BETWEEN MICROSCOPIC QUANTITIES AND OBSERVED ELECTRICAL BEHAVIOUR
2005 Cossi, Maurizio; M., Iozzi
HYBRID DESCRIPTION OF SOLVENT EFFECTS IN AB INITIO CALCULATIONS
2004 Cossi, Maurizio; Rega, Nadia; R., Improta; Crescenzi, Orlando; Barone, Vincenzo
Ab Initio Theoretical Study of Substituted Dicarboxylic Acids Adsorbed on GaAs Surfaces: Correlation between Microscopic Properties and Observed Electrical Behavior
2005 M. F., Iozzi; Cossi, Maurizio
A theoretical study of ethylene, cyclopentene and 1-amino-3-cyclopentene adsorption on the silicon <100> surface
2006 Cantele, Giovanni; Trani, Fabio; Ninno, Domenico; Cossi, Maurizio; Barone, Vincenzo
Order Parameters of α,ω-diphenylpolyenes in a nematic Liquid Crystal from an Integrated Computational and 13C NMR Spectroscopic Approach
2006 Benzi, Caterina; Cossi, Maurizio; Barone, Vincenzo; R., Tarroni; C., Zannoni
A combined theoretical and experimental approach to determining order parameters of solutes in liquid crystals from 13C NMR data
2005 Benzi, Caterina; Cossi, Maurizio; Barone, Vincenzo; R., Tarroni; C., Zannoni
A first-principle study of the adsorption of 1-amino-3-cyclopentene on the (100) silicon surface
2005 Festa, Gaetano; Cossi, Maurizio; Barone, Vincenzo; Cantele, Giovanni; Ninno, Domenico; Iadonisi, Giuseppe