Ribonucleic acid (RNA) is one of life's most versatile molecules, with roles going far beyond being a messenger of genetic code, as it is fundamentally involved in gene regulation, processing, and ...
A fast and accurate surrogate model screens over 10,000 possible metal-oxide supports for a platinum nanocatalyst to prevent ...
Molecular Dynamics Simulations are grounded in classical mechanics, particularly Newton’s laws of motion, to predict how particles move within a system. The force acting on each atom is calculated ...
A fast and accurate surrogate model screens over 10,000 possible metal-oxide supports for a platinum nanocatalyst to prevent sintering under high temperatures.
Simulations comparing aluminum oxide models with differing amounts of corrugation demonstrate the significance of hydroxyl ...
Sandia National Laboratories announced today a new speed record in molecular dynamics simulation. A collaborative research team ran simulations using the Cerebras Wafer Scale Engine (WSE) processor ...
When we do things like quantum calculations, we look at the confirmer space. So what that does is give us insight into how a ...
The understanding of complex many-body dynamics in laser-driven polyatomic molecules is crucial for any attempt to steer ...
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