Search arXivSearch

arXiv · 1912.12691

Supramolecular physics of ambient water

Also available from

Abstract

In temperature range from 0 C to 100 C, abnormality of ambient water properties, at normal pressure, are mainly defined by the physic of hydrogen bonds in supramolecular structures (SMS). Application of Arrhenius approximations and modification of temperature dependences (TDs) for 15 physical characteristics of water made it possible to define their activation energies and to differentiate the contributions of equilibrium thermal processes and those of SMS reconfigurations. Reactions of hydrogen bonds breakage and those of hexagonal ice-like clusters transformation limit TDs of viscosity and rotation-translational self-diffusion. Limitation of degrees of freedom of these motions by the effect of anisotropic external factors leads to the reduction of activation energy for TDs of compressibility, sound velocity and thermal conductivity nearly sixfold. Equality of absolute values of activation energies, having opposite signs, for the thermal and configurational components of TDs, in its point of extremum, is the condition of TDs extrema for volumetric density, heat capacity at constant pressure, compressibility and sound velocity. In this case, space time correlation of water dynamics takes place on the supramolecular level, followed by constant-energy transition between metastable SMS phases.

Explore related subjects

Keep this discovery

Explore connections, maps & timelines

BibTeXRIS

Alexander Kholmanskiy. 2020-04-01. Supramolecular physics of ambient water. https://doi.org/10.1016/j.molliq.2020.115237

Cite the original work for its findings. Save a collection to share your selection of sources.

KEEP EXPLORING

Related papers

Intrinsic Matching Frustration in Fluctuating Finite Systems

We formulate intrinsic matching frustration (IMF), a fluctuation-induced, kinetics-independent reduction in the mean capacity permitted by a prescribed matching rule. For complementary one-to-one matching, the instantaneous capacity is set by the minority population, so fluctuations produce a nonzero mean deficit even when the two populations are balanced on average. At finite size, this deficit depends on the full distribution of the population difference and is determined by its variance alone only in the Gaussian limit. Compartmentalization hides matching capacity by preventing cancellation between local imbalances of opposite sign. Fusion releases this hidden capacity monotonically under coarse graining, producing a measurable recovery of product yield following local reaction to completion.

physics.chem-ph

Phonon chirality as an additive control of CISS: a symmetry-protected law

Chirality-induced spin selectivity (CISS) is usually associated with molecular handedness. The possible contribution of chiral phonons is less established. We study a helical tight-binding model in which local phonon angular momentum modulates spin-dependent nearest-neighbor hopping. Fewest-switches surface hopping calculations give the transmitted spin polarization $\mathrm{SP}=aC+b\mathrm{PH}$. Here $C$ is the molecular chirality and $\mathrm{PH}$ is the phonon chirality. A mirror symmetry reverses $C$, $\mathrm{PH}$, and $\mathrm{SP}$ simultaneously. This symmetry excludes both a chirality-independent offset and a $C\cdot\mathrm{PH}$ term. The phonon contribution can therefore enhance, cancel, or reverse the molecular CISS signal.

physics.chem-ph

A fast physics-based matrix model for the impedance of a PEM fuel cell: Incorporating functionally graded catalyst layer and channel impedances

We extend a recent physics-based matrix model for calculating PEM fuel cell impedance (doi:10.1149/2754-2734/ad6ce8) to cases of low air flow stoichiometry and functionally graded cathode catalyst layers (CCLs). We demonstrate that the matrix model produces accurate spectra and is almost three orders of magnitude faster than a model based on the standard boundary-value problem solver. The physics-based matrix model can compete with equivalent circuit models for fitting experimental EIS spectra, particularly those measured from cells with functionally graded CCL.

physics.chem-ph