Results 121 to 130 of about 2,837,565 (258)

Calculation of Virial Coefficients and Their Uses

This work is centers on the classical statistical derivation of thermodynamic properties of a system from its pair potential through the calculation of virial coefficients and also develops a useful method for modeling systems with the square-well ...
Getter, Nicholas
core  

Phase behavior in multicomponent mixtures

Frontiers in Soft Matter
In this article, we study the phase behavior of two polydisperse hydrocolloids: dextran and polyethylene oxide. We combine the data on the experimental osmometric virial coefficients of the pure components with the experimental critical point of their ...
Luka Sturtewagen, Belinda P. C. Dewi, Arjen Bot, Arjen Bot, Paul Venema, Erik van der Linden   +5 more
doaj   +1 more source

Quantum virial coefficients via path integral Monte Carlo: Theory and development of novel algorithms

, 2016
Virial coefficients are unique thermodynamic properties of a system owing to their link be- tween interactions at the molecular level to macroscopic quantities such as the pressure.
Subramanian, Ramachandran
core  

Second virial coefficients and the arsenic vapor-condensed phase equilibrium

, 1999
The published temperature-pressure-vapor density data for As can be fit to 1.07% with two-parameter second virial coefficients for As2 and As4. In contrast to the assumptions of previous analyses of the As system, the vapor already shows significant ...
R. F. Brebrick, Brebrick, Robert F.
core   +1 more source

Advances of Mayer's cluster approach in quantitative theoretical description of phase transitions for various lattice models of matter

Condensed Matter Physics
Resent achievements in Statistical Theory, namely, a possibility to reproduce almost unlimited Mayer's activity series based on the information about their convergence radius, on the one hand, and generalization of the Lattice Statistics by eliminating ...
M. Ushcats, L. Bulavin, S. Ushcats, Z. Burunina, O. Maiboroda, N. Romanchuk, N. Shapoval   +6 more
doaj   +1 more source

Theoretical pressure and dielectric second virial coefficients of CO-Ar

, 2008
Using coupled cluster singles and doubles linear response theory and the d-aug-cc-pVTZ basis set extended with a 3s3p2d1f1g set of midbond functions, the interaction induced electric dipole polarisability surface of the CO-Ar van der Waals complex is ...
Fernandez, Berta, Jansik, Branislav, Pedersen, Thomas,, Bondo Pedersen, Thomas, Pedersen, Thomas, Lopez Cacheiro, Javier, Fernandez Rodriguez, Berta, Lund University., Rizzo, Antonio   +8 more
core   +1 more source

The Relation Between the Volume Virial Coefficients and the Pressure Virial Coefficients

Zeitschrift für Physikalische Chemie, 1976
Vassiliadou-Athanassiou, S., Yannakopoulos, T.Y.   +1 more
openaire   +2 more sources

Eighth to sixteenth virial coefficients of the Lennard-Jones model.

Journal of Chemical Physics, 2015
Chao Feng, A. Schultz, V. Chaudhary, D. Kofke   +3 more
semanticscholar   +1 more source

Calculation of Second Virial Coefficients of Atomistic Proteins Using Fast Fourier Transform. [PDF]

J Phys Chem B, 2019
Qin S, Zhou HX.
europepmc   +1 more source