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Classical-trajectory calculations of the electronic stopping cross-section for low-energy H and H+ projectiles by H2-molecules
(Taylor & Francis Ltd, 2013-10)
A model that enables the classical-trajectory simulation of the interaction between an atomic particle and a target containing one or more electrons is devised. It makes use of the so-called Gaussian kernel approximation ...
The density profile of the six vertex model with domain wall boundary conditions
(IOP Publishing, 2020)
Numerical simulations study of a spin-1 Blume-Emery-Griffiths model on a square lattice
(IOP Publishing, 2019-03-18)
We use the Monte Carlo simulation technique to study the critical behavior of a three-state spin model, with bilinear and biquadratic nearest-neighbor interactions, known as the Blume-Emery-Griffiths model (BEG), in a ...
Phase diagram and critical behavior of the antiferromagnetic Ising model in an external field
(Universidade Federal de Minas GeraisBrasilICX - DEPARTAMENTO DE FÍSICAUFMG, 2016-03-17)
Modeling the uncertainty in response surface methodology through optimization and Monte Carlo simulation: An application in stamping process
(Elsevier B.V., 2019-07-05)
Among the most frequently used experimental design techniques is the response surface methodology (RSM), which uses an approximation of the real objective function, in the form of an empirical quadratic function. RSM allows ...
Aging and stationary properties of non-equilibrium symmetrical three-state models
(IOP PUBLISHING LTD, 2011)
We consider a non-equilibrium three-state model whose dynamics is Markovian and displays the same symmetry as the three-state Potts model, i.e. the transition rates are invariant under the cyclic permutation of the states. ...
Mechanism and kinetics parameters of the reduction reaction of NO by CO on Pd/Al2O3 catalyst
(AMER CHEMICAL SOCIETY, 2007-05)
By means of a mechanism similar to that used by Peden and Permana for the reduction reaction of NO by
CO on Rh and the analytical solution of its kinetics equations, a set of kinetics parameters that interpret some
experimental ...
C-H center dot center dot center dot O and N-H center dot center dot center dot O hydrogen bonds in liquid amides investigated by Monte Carlo simulation
(Wiley-Blackwell, 1997-12-05)
Monte Carlo simulations of liquid formamide, N-methylformamide (MF), and N,N-dimethylformamide (DMF) have been performed in the isothermal and isobaric ensemble at 298 K and 1 atm, aiming to investigate the C-H ... O and ...
C - H ⋯ 0 and N - H ⋯ 0 hydrogen bonds in liquid amides investigated by monte carlo simulation
(1997-12-01)
Monte Carlo simulations of liquid formamide, N-methylformamide (MF), and N, N-dimethytformamide (DMF) have been performed in the isothermal and isobaric ensemble at 298 K and 1 atm, aiming to investigate the C-H ⋯ O and ...
C-H center dot center dot center dot O and N-H center dot center dot center dot O hydrogen bonds in liquid amides investigated by Monte Carlo simulation
(Wiley-Blackwell, 1997-12-05)
Monte Carlo simulations of liquid formamide, N-methylformamide (MF), and N,N-dimethylformamide (DMF) have been performed in the isothermal and isobaric ensemble at 298 K and 1 atm, aiming to investigate the C-H ... O and ...