502 citations · 1k across the 26 of their papers we have counts for
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Distributed Charge Models of Liquid Methane and Ethane for Dielectric Effects and Solvation
Atul C. Thakur, Richard C. Remsing
Liquid hydrocarbons are often modeled with fixed, symmetric, atom-centered charge distributions and Lennard-Jones interaction potentials that reproduce many properties of the bulk…
Liquid-liquid Phase transitions in silicon
M. W. C. Dharma-wardana, Dennis D. Klug, Richard C. Remsing
We use computationally simple neutral pseudo-atom (`average atom') one-center density functional theory (DFT) and standard N-center DFT-Molecular Dynamics simulations to elucidate…
Effective Mass Path Integral Simulations of Quasiparticles in Condensed Phases
Richard C. Remsing, Jefferson E. Bates
The quantum many-body problem in condensed phases is often simplified using a quasiparticle description, such as effective mass theory for electron motion in a periodic solid. Thes…
Molecular Simulation of Covalent Bond Dynamics in Liquid Silicon
Richard C. Remsing, Michael L. Klein
Many atomic liquids can form transient covalent bonds reminiscent of those in the corresponding solid states. These directional interactions dictate many important properties of th…