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Response to comment on "Superposition of waves or densities: Which is the nature of chemical resonance?"

Yang Wang
Published in: Journal of computational chemistry (2021)
I reply to the comment by Weinhold and Glendening on the article (J. Comput. Chem. 2021, 42, 412). I provide further explanation and an additional numerical example to support my previous assertion that the present form of natural resonance theory is fundamentally flawed, at least within the DFT framework.
Keyphrases
  • energy transfer
  • molecular docking
  • density functional theory
  • quantum dots
  • transition metal