CITATION.cff

cff-version: 1.2.0
title: >-
  Automated Bonding Analysis with Crystal Orbital
  Hamilton Populations
message: >-
  We would like to ask you to cite this article if
  you use our software
authors:
  - given-names: Janine
    family-names: George
    email: janine.george@bam.de
    orcid: 'https://orcid.org/0000-0001-8907-0336'
    affiliation: >-
      Federal Institute for Materials Research and
      Testing, Germany & Friedrich Schiller
      University Jena
  - given-names: Guido
    family-names: Petretto
  - given-names: 'Aakash '
    family-names: Naik
  - given-names: Marco
    family-names: Esters
  - given-names: Adam J.
    family-names: Jackson
  - given-names: Ryky
    family-names: Nelson
  - given-names: Richard
    family-names: Dronskowski
  - given-names: Gian-Marco
    family-names: Rignanese
  - given-names: Geoffroy
    family-names: Hautier
doi: 10.1002/cplu.202200123
url: https://github.com/JaGeo/LobsterPy
journal: ChemPlusChem
year: 2022