In this video from Supercomputer Frontiers Europe 2020, Alexandros N. Ziogas from ETH Zurich presents: A Data-Centric Approach to Extreme-Scale Ab initio Dissipative Quantum Transport Simulations. The ...
A general workflow towards fully ab initio simulation of atmospheric aerosol nucleation. It includes the steps to prepare the data set for training a deep neural network-based force field (DNN-FF), to ...
Dr. Natalia Solomatova CNRS, ENS de Lyon will discuss the chemical evolution of Earth and other terrestrial planets dictates their present-day mineralogy, structure and dynamic processes. Despite the ...
A machine learning pipeline identifies low-frequency Raman signatures as reliable indicators of liquid-like ionic conduction ...
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