Calculations of magnetically induced current densities: theory and applications

Dage Sundholm, Heike Fliegl, Raphael J. F. Berger

Research output: Contribution to journalReview ArticleScientificpeer-review

Original languageEnglish
JournalWiley interdisciplinary reviews: Computational molecular science
Volume6
Issue number6
Pages (from-to)639-678
Number of pages40
ISSN1759-0876
DOIs
Publication statusPublished - Dec 2016
MoE publication typeA2 Review article in a scientific journal

Fields of Science

  • NMR CHEMICAL-SHIFTS
  • MOLECULAR CHARGE-DISTRIBUTIONS
  • HARTREE-FOCK CALCULATIONS
  • ELECTRONIC-STRUCTURE CALCULATIONS
  • INCLUDING ATOMIC ORBITALS
  • POTENTIAL-ENERGY SURFACE
  • COINAGE-METAL-CLUSTERS
  • SELF-CONSISTENT-FIELD
  • RING CURRENT MODEL
  • SPHERICAL AROMATICITY
  • 116 Chemical sciences

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