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Systematically Improvable Models from Alchemical Perturbations - IPAM UCLA

Systematically Improvable Models from Alchemical Perturbations - IPAM UCLA

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

Gauss basis sets

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Gauss basis sets

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Systematically Improvable Models from Alchemical Perturbations - IPAM UCLA

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  1. 1 Motivation
  2. 2 Quantum Alchemy
  3. 3 Example
  4. 4 Taylor expansion
  5. 5 Convergence
  6. 6 Examples
  7. 7 Symmetry
  8. 8 Detailing
  9. 9 Technical limitations
  10. 10 Gauss basis sets
  11. 11 Conclusion

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