Quantum Embedding Methods for Correlated Excited States of Point Defects

Quantum Embedding Methods for Correlated Excited States of Point Defects

Institute for Pure & Applied Mathematics (IPAM) via YouTube Direct link

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16 of 22

16 of 22

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Quantum Embedding Methods for Correlated Excited States of Point Defects

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  1. 1 Introduction
  2. 2 Background
  3. 3 What are we interested in
  4. 4 Defects in condensed matter
  5. 5 Applications of point defects
  6. 6 Energy scale of point defects
  7. 7 Field of Quantum Materials
  8. 8 Motivation
  9. 9 Embedding theories
  10. 10 How does the method work
  11. 11 Defining the correlated subspace
  12. 12 Linear functions
  13. 13 Assumptions challenges
  14. 14 Quantum chemical approach
  15. 15 Small active space
  16. 16 Heart rate fog
  17. 17 Results
  18. 18 Dependence of DFT
  19. 19 Double counting
  20. 20 Double counting with HSE
  21. 21 Twosided hybrid model
  22. 22 Conclusion

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