Simulation of Electronic and Geometric Degrees of Freedom Using a kink-Based Path Integral Formulation: Application to Molecular Systems

Randall W. Hall

Research output: Contribution to journalArticlepeer-review

Original languageAmerican English
JournalThe Journal of Chemical Physics
Volume122
DOIs
StatePublished - Jan 1 2005
Externally publishedYes

Keywords

  • Excited States
  • Light Emitting Diodes
  • Ab Initio Calculations
  • Ground States
  • Monte Carlo Methods

Disciplines

  • Chemistry

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