Papers: 10.1021/acs.jpclett.1c02031

https://doi.org/10.1021/acs.jpclett.1c02031

Nitrogen <i>K</i>-Edge X-ray Absorption Spectra of Ammonium and Ammonia in Water Solution: Assessing the Performance of Polarizable Embedding Coupled Cluster Methods

Cited by: 8
Author(s): Peter Reinholdt, Marta L. Vidal, Jacob Kongsted, Marcella Iannuzzi, Sonia Coriani, Michael Odelius
Published: about 5 years ago

Software Mentions 1

pypi: PyFraME
PyFraME: Python framework for Fragment-based Multiscale Embedding
Papers that mentioned: 3
Very Likely Science (100)