0000000000824767

AUTHOR

Francesco Ancilotto

showing 3 related works from this author

Toward a density functional description of liquid pH2.

2010

A finite-temperature density functional approach to describe the properties of parahydrogen in the liquid-vapor coexistence region is presented. The first proposed functional is zero-range, where the density-gradient term is adjusted so as to reproduce the surface tension of the liquid-vapor interface at low temperature. The second functional is finite-range and, while it is fitted to reproduce bulk pH2 properties only, it is shown to yield surface properties in good agreement with experiments. These functionals are used to study the surface thickness of the liquid-vapor interface, the wetting transition of parahydrogen on a planar Rb model surface, and homogeneous cavitation in bulk liquid…

Surface (mathematics)Chemical Physics (physics.chem-ph)Statistical Mechanics (cond-mat.stat-mech)Yield surfaceChemistryThermodynamicsFOS: Physical sciencesFísicaCondensed Matter - Soft Condensed MatterSpin isomers of hydrogenFunctional descriptionSurface tensionPhysics::Fluid DynamicsPlanarWetting transitionPhysics - Chemical PhysicsCavitationPhysics::Atomic and Molecular ClustersSoft Condensed Matter (cond-mat.soft)Physical and Theoretical ChemistryCondensed Matter - Statistical MechanicsThe journal of physical chemistry. A
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Cavitation of electron bubbles in liquid parahydrogen

2011

Within a finite-temperature density functional approach, we have investigated the structure of electron bubbles in liquid parahydrogen below the saturated vapour pressure, determining the critical pressure at which electron bubbles explode as a function of temperature. The electron-parahydrogen interaction has been modelled by a Hartree-type local potential fitted to the experimental value of the conduction band-edge for a delocalized electron in pH(2). We have found that the pressure for bubble explosion is, in absolute value, about a factor of two smaller than that of the homogeneous cavitation pressure in the liquid. Comparison with the results obtained within the capillary model shows t…

Capillary actionChemistryVapor pressureBubbleBiophysicselectron bubblesElectronCondensed Matter PhysicsSpin isomers of hydrogenThermal conductionMolecular physicsPhysics::Fluid Dynamicscapillary approximationNuclear magnetic resonanceCavitationliquid parahydrogenPhysics::Atomic and Molecular ClustersDensity functional theoryPhysical and Theoretical ChemistryMolecular Biologydensity functional theoryMolecular Physics
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Nucleation and cavitation in parahydrogen

2012

We have used a density functional approach to investigate thermal homogeneous nucleation and cavitation in parahydrogen. The effect of electrons as seeds of heterogeneous cavitation in liquid parahydrogen is also discussed within the capillary model. (C) 2011 Elsevier B.V. All rights reserved.

CavitationMetastable phasesChemistryCapillary actionPhysics::Medical PhysicsNucleationGeneral Physics and AstronomyElectronPhysics::Classical PhysicsSpin isomers of hydrogenPhysics::Fluid DynamicsPhysics::Plasma PhysicsHomogeneousChemical physicsCavitationThermalPhysics::Atomic and Molecular ClustersNucleationPhysical chemistryPhysical and Theoretical ChemistryLiquid parahydrogen
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