This file is automatically generated. It contains the descriptions of each uploaded file as provided by the user.
- README.txt: Summary of content
- NQE_Repository.zip: This folder contains the input and starting files for the paper 'Nuclear Quantum Effects on the Electronic Structure of Water and Ice' including starting files for the classical and quantum simulations using lammps and i-pi with the NEP and DNNP, starting files for electronic structure calculations using CP2K with the revPBE0 functional, Qbox with the SCAN functional, and WEST