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Multi-Component Molecular Orbital Theory, Paperback / softback Book

Multi-Component Molecular Orbital Theory Paperback / softback

Paperback / softback

Description

This book presents the multi-component first-principles methods which can take account of the quantum effect of light particles such as proton and positron, as well as electron.

In particular, the authors introduce their multi-component molecular orbital (MC_MO) methods and multi-component "hybrid type" density functional theory (MC_DFT).

Using these multi-component procedure, the authors can analyse many chemical phenomena, H/D isotope effect, positronic systems, and so on.

The authors show some examples of MC_MO and MC_DFT works.

Information

  • Format:Paperback / softback
  • Pages:60 pages, Illustrations, unspecified
  • Publisher:Nova Science Publishers Inc
  • Publication Date:
  • Category:
  • ISBN:9781604569346
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Information

  • Format:Paperback / softback
  • Pages:60 pages, Illustrations, unspecified
  • Publisher:Nova Science Publishers Inc
  • Publication Date:
  • Category:
  • ISBN:9781604569346