Sfoglia per Rivista THE JOURNAL OF CHEMICAL PHYSICS
Delayed rejection variational Monte Carlo
2004-01-01 Bressanini, Dario; Morosi, Gabriele; Tarasco, Silvia; Mira, Antonietta
Diffusion Monte Carlo simulations of gas phase and adsorbed D2-(H2)nclusters
2018-01-01 Curotto, E.; Mella, M.
Dipolar host guest interactions and geometrical confinement at the basis of the stability of one-dimensional ice in zeolite bikitaite
1999-01-01 Fois, ETTORE SILVESTRO; Tabacchi, Gloria; Quartieri, S; Vezzalini, G.
Discretization error-free estimate of low temperature statistical dissociation rates in gas phase: Applications to Lennard-Jones clusters X(13-n)Y(n) (n=0-3)
2008-01-01 Mella, Massimo
Dynamics of photoexcited Ba+ cations in 4He nanodroplets
2016-01-01 Leal, Antonio; Zhang, Xiaohang; Barranco, Manuel; Cargnoni, Fausto; Hernando, Alberto; Mateo, David; Mella, Massimo; Drabbels, Marcel; Pi, Martí
e+(PsH)2: A three-positron molecule with a positronic chemical bond
2022-01-01 Bressanini, Dario
Effect of the cluster angular momentum J and the projectile orbital momentum L on capture probability and postcollision dynamics
2009-01-01 Mella, Massimo
Efficient and robust quantum Monte Carlo estimate of the total and spin electron densities at nuclei
2008-01-01 P., Hakansson; Mella, Massimo
Efficient calculation of low energy statistical rates for gas phase dissociation using umbrella sampling
2006-01-01 Mella, Massimo
Electronic quantum Monte Carlo calculations of atomic forces, vibrations, and anharmonicities
2005-01-01 M. W., Lee; Mella, Massimo; A. M., Rappe
Energy and density analyses of the H2 molecule from the united atom to dissociation: the 1 Sigma g states.
2009-01-01 Corongiu, Giorgina; E., Clementi
Energy and density analysis of the H2 molecule from the united atom to dissociation: The 3 Sigma g and 3 Sigma u states.
2009-01-01 Corongiu, Giorgina; Clementi, E.
Enhancement of depletion forces by electrostatic depletant repulsion
2010-01-01 Buzzaccaro, S.; Piazza, R.; Colombo, Jader; Parola, Alberto
Exploring the importance of quantum effects in nucleation: The archetypical Ne_n case
2012-01-01 Unn Toc, W.; Halberstadt, N.; Meier, C.; Mella, Massimo
Fluctuating pseudoatoms in metallic fluids
1989-01-01 Goldstein, R. E.; Parola, Alberto; Smith, A. P.
Ground state and excitation dynamics in Ag doped helium clusters
2002-01-01 Mella, Massimo; M. C., Colombo; Morosi, Gabriele
Ground state and excitation dynamics in Ag doped helium clusters
2002-01-01 Mella, Massimo; Colombo, Mc; Morosi, Gabriele
Ground state potential energy surfaces and bound states of M-He dimers (M=Cu,Ag,Au): A theoretical investigation
2008-01-01 F., Cargnoni; T., Kus; Mella, Massimo; R. J., Bartlett
Higher order diffusion Monte Carlo propagators for linear rotors as diffusion on a sphere: Development and application to O(2)@He(n)
2011-01-01 Mella, Massimo
Hydrophobic effects: A computer simulation study of the temperature influence in dilute O-2 aqueous solutions
1999-01-01 Fois, ETTORE SILVESTRO; Gamba, Aldo; Redaelli, C.
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