Confinement induced chemical bonding: Case of noble gases

Sudip Pan, Gabriel Merino, Lili Zhao

Research output: Chapter in Book/Report/Conference proceedingChapterpeer-review

Abstract

Chemical bonding is a fuzzy concept in chemistry defined based on different models since it is neither an experimentally observable quantity nor there is any Hermitian quantum mechanical operator corresponding to this. This chapter presents some examples to show how confinement can even induce chemical bonding in between two noble gas (Ng) atoms in true sense. The Xe-Xe bond can undoubtedly be assigned as a genuine chemical covalent bond and the Ar-Ar and Kr-Kr bonds have at least some partial covalent character. Depending on the size of cavitand and size of the Ng, the degree of covalent bond formation either between Ng and cage centers or between two Ng atoms gets formed. Confinement of Ng2 becomes a playground for the application of different bonding models and each model has their own advantages and limitations which further create debate.

Original languageEnglish
Title of host publicationChemical Reactivity in Confined Systems
Subtitle of host publicationTheory, Modelling and Applications
PublisherWiley-Blackwell
Pages239-261
Number of pages23
ISBN (Print)9781119683353
DOIs
StatePublished - 13 Aug 2021

Keywords

  • Hermitian quantum
  • Induce chemical bonding
  • Noble gas
  • Xe-Xe bond

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