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Displaying 226 - 250 of 826

Properties of Ice and Supercooled Water

January 1, 2019
Author(s)
Allan H. Harvey
This is an update to an existing table in the CRC Handbook of Chemistry and Physics, updating to the latest IAPWS recommendation for thermodynamic properties of supercooled water.

Properties of Saturated Liquid D2O

January 1, 2019
Author(s)
Allan H. Harvey
Update of existing table in CRC Handbook, reflecting new IAPWS equation of state for heavy water.

Hidden Hyperuniformity in Bottlebrush Polymer Melts

December 21, 2018
Author(s)
Alexandros Chremos, Jack F. Douglas
We show that the backbone chains of bottlebrush polymer melts exhibit a hidden hyperuniform packing over a wide temperature range above glass transition temperature. These findings open a venue for a practical design of hyperuniform polymeric materials for

A Reference Equation of State for Heavy Water

December 3, 2018
Author(s)
Stefan Herrig, Monika Thol, Allan H. Harvey, Eric Lemmon
An empirical fundamental equation of state is presented for heavy water (deuterium oxide, D2O). The equation is explicit in the reduced Helmholtz energy and allows the calculation of all thermodynamic properties over the whole fluid surface. It is valid

Highly mechanosensitive ion channels from graphene-embedded crown ethers

November 26, 2018
Author(s)
Alta Y. Fang, Kenneth Kroenlein, Demian Riccardi, Alex Smolyanitsky
The ability to tune ionic permeation across nanoscale pores profoundly impacts diverse fields from nanofluidic computing to drug delivery. Here, we take advantage of complex formation between crown ethers and dissolved metal ions to demonstrate graphene

Best Practices for Quantification of Uncertainty and Sampling Quality in Molecular Simulations

October 27, 2018
Author(s)
Alan Grossfield, Paul Patrone, Daniel R. Roe, Andrew J. Schultz, Daniel Siderius, Daniel M. Zuckerman
The quantitative assessment of uncertainty and sampling quality is essential in molecular simulation. Many systems of interest are highly complex, often at the edge of current computational capabilities. Modelers must therefore analyze and communicate

Reference Correlations for the Thermal Conductivity of 13 Inorganic Molten Salts

September 19, 2018
Author(s)
Ch. D. Chliatzou, Marc J. Assael, K.D. Antoniadis, Marcia L. Huber, William A. Wakeham
The available experimental data for the thermal conductivity of the inorganic molten salts (KNO3, LiNO3, NaNO3, KBr, NaBr, RbBr, CsCl, KCl, LiCl, NaCl, RbCl, NaI, and RbI), have been critically examined with the intention of establishing thermal

REFERENCE VALUES AND REFERENCE CORRELATIONS FOR THE THERMAL CONDUCTIVITY AND VISCOSITY OF FLUIDS

June 22, 2018
Author(s)
Marc J. Assael, A.E. Kalyva, S.A. Monogenidou, Marcia L. Huber, Richard A. Perkins, Daniel G. Friend, Eric F. May
In this paper reference values and reference correlations for the thermal conductivity and viscosity of pure fluids are presented. Reference values and correlations for the thermal conductivity and the viscosity of pure fluids provide thoroughly evaluated
Displaying 226 - 250 of 826