Table of Contents

Crystal structures database

  1. Bilbao Crystallographic Server : http://www.cryst.ehu.es/
  2. Crystallography Open Database : http://www.crystallography.net/cod/search.html
  3. Material Project: https://materialsproject.org/

Basis set database

Modeling Software

Useful Tutorial

Data visualization

  1. Ploty - online interactive matplotlib : https://plot.ly/matplotlib/

Report writing