Source code, input data, and sample output concerning the application of multistate density functional theory to the singdoublet and tripdoublet states of the ethylene cation

Lignende værker

• Spin-Multiplet Components and Energy Splittings by Multistate Density Functional Theory
  af: Grofe, Adam, et al.
  Udgivet: (2017)
• Beyond Kohn–Sham Approximation: Hybrid Multistate Wave Function and Density Functional Theory
  af: Gao, Jiali, et al.
  Udgivet: (2016)
• Diabatic-At-Construction Method for Diabatic and Adiabatic Ground and Excited States Based on Multistate Density Functional Theory
  af: Grofe, Adam, et al.
  Udgivet: (2017)
• Multistate Density Functional Theory for Effective Diabatic Electronic Coupling
  af: Ren, Haisheng, et al.
  Udgivet: (2016)
• Input-output techniques : proceedings on Hungarian Conference in input-output techniques. --
  af: (Hungarian on Input-output Techniques, et al.
  Udgivet: (1976.)