56 citations · 253 across the 22 of their papers we have counts for
22 papers
V-T theory for the Self-Intermediate Scattering Function in a Monatomic Liquid
Duane C. Wallace, Eric D. Chisolm, Giulia De Lorenzi-Venneri
In V-T theory the atomic motion is harmonic vibrations in a liquid-specific potential energy valley, plus transits, which move the system rapidly among the multitude of such valley…
Atomic Motion from the Mean Square Displacement in a Monatomic Liquid
Duane C. Wallace, Giulia De Lorenzi-Venneri, Eric D. Chisolm
V-T theory is constructed in the many-body Hamiltonian formulation, and differs at the foundation from current liquid dynamics theories. In V-T theory the liquid atomic motion cons…
Thermal electronic excitations in liquid metals
Eric D. Chisolm, Nicolas Bock, Sven P. Rudin +1
Thermal electronic excitations in metal crystals are calculated by starting with a reference structure for the nuclei: the crystal structure of the appropriate phase. Here we expla…
Application of vibration-transit theory to distinct dynamic response for a monatomic liquid
Duane C. Wallace, Eric D. Chisolm, Giulia De Lorenzi-Venneri
We examine the distinct part of the density autocorrelation function Fd(q,t), also called the intermediate scattering function, from the point of view of the vibration-transit (V-T…
Liquid state properties from first principles DFT calculations: Static properties
Nicolas Bock, Erik Holmstrom, Travis B. Peery +4
In order to test the Vibration-Transit (V-T) theory of liquid dynamics, ab initio density functional theory (DFT) calculations of thermodynamic properties of Na and Cu are performe…
Statistical mechanics model for the transit free energy of monatomic liquids
Duane C. Wallace, Eric D. Chisolm, N. Bock +1
In applying Vibration-Transit (V-T) theory of liquid dynamics to the thermodynamic properties of monatomic liquids, the point has been reached where an improved model is needed for…