Related Experiment Video
Updated: Jun 8, 2026

Analyzing Melts and Fluids from Ab Initio Molecular Dynamics Simulations with the UMD Package
Published on: September 17, 2021
On the relation between the microscopic structure and the sound velocity anomaly in elemental melts of groups IV, V,
Yaron Greenberg1, Eyal Yahel, El'ad N Caspi
1Department of Materials Engineering, Ben Gurion University of the Negev, Beer-Sheva 84105, Israel. yargreen@zahav.net.il
Abstract:
The sound velocity of some liquid elements of groups IV, V, and VI, as reported in the literature, displays anomalous features that set them apart from other liquid metals. In an effort to determine a possible common origin of these anomalies, extensive neutron diffraction measurements of liquid Bi and Sb were carried out over a wide temperature range. The structure factors of liquid Sb and Bi were determined as a function of temperature. The structure of the two molten metals was carefully analyzed with respect to peak locations, widths, and coordination numbers in their respective radial distribution function. The width of the peaks in the radial distribution functions was not found to increase and even decreased within a certain temperature range. This anomalous temperature dependence of the peak widths correlates with the anomalous temperature dependence of the sound velocity. This correlation may be accounted for by increased rigidity of the liquid structure with temperature. A phenomenological correlation between the peak width and the sound velocity is suggested for metallic melts and is found to agree with available data for normal and anomalous elemental liquids in groups IV-VI.
Related Concept Videos
Speed of Sound in Solids and Liquids
Molecular and Ionic Solids
Molecular Solids
Molecular crystalline solids, such as ice, sucrose (table sugar), and iodine, are solids that are composed of neutral molecules as their constituent units. These molecules are held together by weak intermolecular forces such as London dispersion forces, dipole-dipole interactions, or hydrogen bonds, which...
Theory of Metallic Conduction
In this theory, Newton's second law of motion is used to determine the acceleration of an electron in the presence of an applied electric field. Then, its velocity is expressed via this acceleration.
An electron moves through the crystal, containing positive ions,...
Deriving the Speed of Sound in a Liquid
The speed of sound in fluids can be derived by considering a mechanical wave propagating...
Imperfections in Crystal Structure: Non-Stoichiometric Defects
Structures of Solids

