Sfoglia per Autore
LIBRATIONAL DYNAMICS OF WATER IN TERMS OF ANGULAR VELOCITY CORRELATION-FUNCTIONS AND ORIENTATIONAL STRUCTURE
1992-01-01 Bertolini, D; Tani, Alessandro
ABINITIO EFFECTIVE PAIR POTENTIALS FOR SIMULATIONS OF THE LIQUID-STATE, BASED ON THE POLARIZABLE CONTINUUM MODEL OF THE SOLVENT
1992-01-01 Floris, FRANCA MARIA; Persico, Maurizio; Tani, Alessandro; Tomasi, J.
THE FREQUENCY AND WAVELENGTH DEPENDENT DIELECTRIC PERMITTIVITY OF WATER
1992-01-01 Bertolini, D; Tani, Alessandro
Ab initio effective pair potentials for simulations of the liquid state, based on the polarizable continuum model of the solvent
1992-01-01 Floris, FRANCA MARIA; Persico, Maurizio; Tani, Alessandro; Tomasi, Iacopo
Evaluation of dispersion-repulsion contributions to the solvation energy. Calibration of the uniform approximation with the aiad of RISM calculations
1993-01-01 Floris, FRANCA MARIA; Tani, Alessandro; Tomasi, Iacopo
Hydration shell structure of the calcium ion from simulations with ab initio effective pair potentials.
1994-01-01 Floris, FRANCA MARIA; Persico, Maurizio; Tani, Alessandro; Tomasi, Iacopo
STRESS TENSOR AND VISCOSITY OF WATER - MOLECULAR-DYNAMICS AND GENERALIZED HYDRODYNAMICS RESULTS
1995-01-01 Bertolini, D; Tani, Alessandro
FREE-ENERGIES AND STRUCTURES OF HYDRATED CATIONS, BASED ON EFFECTIVE PAIR POTENTIALS
1995-01-01 Floris, FRANCA MARIA; Persico, Maurizio; Tani, Alessandro; Tomasi, Iacopo
GENERALIZED HYDRODYNAMICS AND THE ACOUSTIC MODES OF WATER - THEORY AND SIMULATION RESULTS
1995-01-01 Bertolini, D; Tani, Alessandro
Thermal conductivity of water: Molecular dynamics and generalized hydrodynamics results
1997-01-01 Bertolini, D; Tani, Alessandro
Free energy and entropy for inserting cavities in water: Comparison of Monte Carlo simulation and scaled particle theory results
1997-01-01 Floris, FRANCA MARIA; Selmi, M; Tani, Alessandro; Tomasi, Iacopo
Viscous versus elastic response of hydrogen-bonded liquids: collective dynamics in HF
1998-01-01 Bertolini, D.; Sutmann, G.; Tani, Alessandro; Vallauri, R.
Velocity correlations in liquid hydrogen fluoride
1999-01-01 Balucani, U.; Bertolini, D.; Sutmann, G.; Tani, Alessandro; Vallauri, R.
Nonadiabatic dynamics in solution: MD and surface hopping
1999-01-01 Cattaneo, P.; Persico, Maurizio; Tani, Alessandro
Interaction potentials for small molecules
1999-01-01 Floris, FRANCA MARIA; Tani, Alessandro
Transport properties of liquid hydrogen fluoride
2000-01-01 Balucani, U.; Bertolini, D.; Tani, Alessandro; Vallauri, R.
A study of aqueous solutions of lanthanide ions by molecular dynamics simulation with ab initio effective pair potentials
2001-01-01 Floris, F. M.; Tani, Alessandro
On the generalized bulk viscosity behavior
2001-01-01 Bertolini, D.; Tani, Alessandro
A study of aqueous solutions of lanthanide ions by molecular dynamics simulation with effective pair potentials
2001-01-01 Floris, FRANCA MARIA; Tani, Alessandro
Computer simulations of pure and mixed systems of disklike particles interacting with the S-function Corner potential
2002-01-01 Cinacchi, G.; Tani, Alessandro
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