Papers: 10.1039/c7sc02267k

https://doi.org/10.1039/c7sc02267k

Machine learning molecular dynamics for the simulation of infrared spectra

Cited by: 333
Author(s): Michael Gastegger, Jörg Behler, Philipp Marquetand
Published: over 9 years ago

Software Mentions 1

pypi: numpy
Fundamental package for array computing in Python
Papers that mentioned: 832
Very Likely Science (100)