Recurrent Neural Network-based Model for Accelerated Trajectory Analysis in AIMD Simulations

23 Sep 2019Mohammad Javad EslamibidgoliMehrdad MokhtariMichael H. Eikerling

The presented work demonstrates the training of recurrent neural networks (RNNs) from distributions of atom coordinates in solid state structures that were obtained using ab initio molecular dynamics (AIMD) simulations. AIMD simulations on solid state structures are treated as a multi-variate time-series problem... (read more)

PDF Abstract

Code


No code implementations yet. Submit your code now

Results from the Paper


  Submit results from this paper to get state-of-the-art GitHub badges and help the community compare results to other papers.

Methods used in the Paper


METHOD TYPE
🤖 No Methods Found Help the community by adding them if they're not listed; e.g. Deep Residual Learning for Image Recognition uses ResNet