502 citations · 1k across the 26 of their papers we have counts for
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Nuclear Quantum Effects in the Acetylene:Ammonia Plastic Co-crystal
Atul C. Thakur, Richard C. Remsing
Organic molecular solids can exhibit rich phase diagrams. In addition to structurally unique phases, translational and rotational degrees of freedom can melt at different state poi…
Modeling Nuclear Quantum Effects on Long Range Electrostatics in Nonuniform Fluids
Richard C. Remsing
Nuclear quantum effects play critical roles in a variety of molecular processes, especially in systems that contain hydrogen and other light nuclei, such as water. For water at amb…
Electronic paddle-wheels in a solid-state electrolyte
Harender S. Dhattarwal, Rahul Somni, Richard C. Remsing
Solid-state superionic conductors (SSICs) are promising alternatives to liquid electrolytes in batteries and other energy storage technologies. The rational design of SSICs and ult…
Dielectric Saturation in Water from a Long Range Machine Learning Model
Harender S. Dhattarwal, Ang Gao, Richard C. Remsing
Machine learning-based neural network potentials have the ability to provide ab initio-level predictions while reaching large length and time scales often limited to empirical forc…