High Accuracy Wavefunctions Using Deep-Learning-Based Variational Monte Carlo

High Accuracy Wavefunctions Using Deep-Learning-Based Variational Monte Carlo

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

Introduction

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1 of 16

Introduction

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High Accuracy Wavefunctions Using Deep-Learning-Based Variational Monte Carlo

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  1. 1 Introduction
  2. 2 Deep learningbased variational Monte Carlo
  3. 3 Deep neural networks
  4. 4 Embedding
  5. 5 Invariants
  6. 6 Envelope orbitals
  7. 7 Spin
  8. 8 Results
  9. 9 Comparison
  10. 10 Relative energies
  11. 11 Backflow factor
  12. 12 Pretraining
  13. 13 Potential energy surface
  14. 14 Architecture
  15. 15 Example ethylene
  16. 16 Conclusion

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