Sign Up to like & get
recommendations!
1
Published in 2017 at "Molecular Simulation"
DOI: 10.1080/08927022.2016.1274984
Abstract: Abstract Artificial neural networks (NNs) are increasingly common in quantum chemistry applications. These models can be trained to higher-level ab-initio calculations and are capable of achieving arbitrary levels of accuracy. The most common applications thus…
read more here.
Keywords:
oxygen interactions;
surface;
interactions dynamic;
network predictions ... See more keywords