Thermal conductivity of ice polymorphs: a computational study.

No abstract is available for this paper.

• Publication year

  2018

• Venue

  Physical Chemistry, Chemical Physics - PCCP

• Publication date

  2018-04-25

• Fields of study

  Materials Science, Medicine, Physics, Environmental Science

• Identifiers
  DOI 10.1039/c8cp01272ePMID 29648555
• External record

  Open on Semantic Scholar

• Source metadata

  Semantic Scholar, PubMed

• No claims are published for this paper.

• No concepts are published for this paper.

• The rich phase behavior of the thermopolarization of water: from a reversal in the polarization, to enhancement near criticality conditions.

  2016cited by this paper
• Temperature inversion of the thermal polarization of water.

  2015cited by this paper
• The boson peak of deeply cooled confined water reveals the existence of a low-temperature liquid-liquid crossover.

  2014cited by this paper
• Communication: minimum in the thermal conductivity of supercooled water: a computer simulation study.

  2014cited by this paper
• Preface: special topic on biological water.

  2014cited by this paper
• Characteristics of thermal conductivity in classical water models.

  2013cited by this paper
• Nonequilibrium molecular dynamics simulations of the thermal conductivity of water: a systematic investigation of the SPC/E and TIP4P/2005 models.

  2012cited by this paper
• Simulating water with rigid non-polarizable models: a general perspective.

  2011cited by this paper
• Thermal conductivity of compressed H 2 O to 22 GPa: A test of the Leibfried-Schlömann equation

  2011cited by this paper
• Thermal conductivity in amorphous ices from molecular dynamics

  2010cited by this paper
• Size effects in molecular dynamics thermal conductivity predictions

  2010cited by this paper
• Quantum contributions in the ice phases: the path to a new empirical model for water-TIP4PQ/2005.

  2009cited by this paper
• The phase diagram of water at high pressures as obtained by computer simulations of the TIP4P/2005 model: the appearance of a plastic crystal phase.

  2009cited by this paper
• Plastic crystal phases of simple water models.

  2009cited by this paper
• Mechanisms for thermal conduction in various polymorphs of methane hydrate

  2009cited by this paper
• A plastic phase of water from computer simulation.

  2008cited by this paper
• Effect of electrostatics techniques on the estimation of thermal conductivity via equilibrium molecular dynamics simulation: application to methane hydrate

  2008cited by this paper
• Water polarization under thermal gradients.

  2008cited by this paper
• Equation of State, Thermal Expansion Coefficient, and Isothermal Compressibility for Ices Ih, II, III, V, and VI, as Obtained from Computer Simulation†

  2007cited by this paper
• A potential model for the study of ices and amorphous water: TIP4P/Ice.

  2005cited by this paper
• A general purpose model for the condensed phases of water: TIP4P/2005.

  2005cited by this paper
• Thermal conductivities of molecular liquids by reverse nonequilibrium molecular dynamics.

  2005cited by this paper
• Radial distribution functions and densities for the SPC/E, TIP4P and TIP5P models for liquid water and ices Ih, Ic, II, III, IV, V, VI, VII, VIII, IX, XI and XII.

  2005cited by this paper
• Thermal conductivity of crystalline and amorphous ices and its implications on amorphization and glassy water.

  2005cited by this paper
• Phase diagram of water from computer simulation.

  2004cited by this paper
• Comparison of atomic-level simulation methods for computing thermal conductivity

  2002cited by this paper
• Constraining the equation of state of fluid H

  2002cited by this paper
• Equilibrium and nonequilibrium molecular-dynamics simulations of the central force model of water

  2001cited by this paper
• The Role of Water in Manufacturing

  2001cited by this paper
• Molecular-dynamics simulation of thermal conductivity of silicon crystals

  2000cited by this paper
• Calculating Electrostatic Interactions Using the Particle−Particle Particle−Mesh Method with Nonperiodic Long-Range Interactions

  1996cited by this paper
• Standard Reference Data for the Thermal Conductivity of Water

  1995cited by this paper
• Fast parallel algorithms for short-range molecular dynamics

  1993cited by this paper
• Thermal conductivity of ice and ice clathrate

  1987cited by this paper
• Canonical dynamics: Equilibrium phase-space distributions.

  1985cited by this paper
• A molecular dynamics method for simulations in the canonical ensemble

  1984cited by this paper
• Viscosity of high-pressure ice VI and evolution and dynamics of Ganymede

  1981cited by this paper
• Polymorphic transitions in single crystals: A new molecular dynamics method

  1981cited by this paper
• Thermal conductivity of ice

  1980cited by this paper
• The Structure and Properties of Water

  1969cited by this paper
• Computer "Experiments" on Classical Fluids. I. Thermodynamical Properties of Lennard-Jones Molecules

  1967cited by this paper
• The Statistical Mechanical Theory of Transport Processes. IV. The Equations of Hydrodynamics

  1950cited by this paper

• Nanoconfinement effects on ice nucleation: Pressure-dependent barrier modulation and temperature gradient-driven regime transition

  2026cites this paper
• Complex Phonon Behaviors Dictate Anisotropic and Nonmonotonic Thermal Transport in Ice Polymorphs.

  2025cites this paper
• Effects of guest molecular occupancy and electric field on thermal conductivity of CO2 hydrates.

  2025cites this paper
• High thermal conductivity and ultralow friction of two-dimensional ice by molecular dynamics simulations

  2024cites this paper
• Molecular Simulations of Thermal Transport across Iron Oxide–Hydrocarbon Interfaces

  2024cites this paper
• Cold Self-Lubrication of Sliding Ice.

  2024cites this paper
• Quantum corrections to molecular dynamics simulations of specific heat capacities of thin ices: Role of adsorption and quasi-liquid layers at interfaces

  2023cites this paper
• Bayesian optimization for effective thermal conductivity measurement of thermal energy storage: An experimental and numerical approach

  2022cites this paper
• Effect of hydrogen bonds on the thermal transport in a precisely branched polyethylene with ordered and amorphous structures

  2022cites this paper
• Local Heat Transfer Control using Liquid Dielectrophoresis at Graphene/Water Interfaces

  2021cites this paper
• The impact of the thermostats on the non-equilibrium computer simulations of the interfacial thermal conductance

  2021cites this paper
• Active Heat Transfer Enhancement by Interface-Localized Liquid Dielectrophoresis Using Interdigitated Electrodes

  2021cites this paper
• Role of the phonon confinement effect and boundary scattering in reducing the thermal conductivity of argon nanowire.

  2021cites this paper