Book Image

Quantum Chemistry and Computing for the Curious

By : Alex Khan, Keeper L. Sharkey, Alain Chancé
Book Image

Quantum Chemistry and Computing for the Curious

By: Alex Khan, Keeper L. Sharkey, Alain Chancé

Overview of this book

Explore quantum chemical concepts and the postulates of quantum mechanics in a modern fashion, with the intent to see how chemistry and computing intertwine. Along the way you’ll relate these concepts to quantum information theory and computation. We build a framework of computational tools that lead you through traditional computational methods and straight to the forefront of exciting opportunities. These opportunities will rely on achieving next-generation accuracy by going further than the standard approximations such as beyond Born-Oppenheimer calculations. Discover how leveraging quantum chemistry and computing is a key enabler for overcoming major challenges in the broader chemical industry. The skills that you will learn can be utilized to solve new-age business needs that specifically hinge on quantum chemistry
Table of Contents (14 chapters)
Chapter 8: References
Chapter 9:Glossary
Appendix B: Leveraging Jupyter Notebooks on the Cloud
Appendix C: Trademarks

Other Books You May Enjoy

If you enjoyed this book, you may be interested in these other books by Packt:

Dancing with Qubits

Robert S. Sutor

ISBN: 9781838827366

  • See how quantum computing works, delve into the math behind it, what makes it different, and why it is so powerful with this quantum computing textbook
  • Discover the complex, mind-bending mechanics that underpin quantum systems
  • Understand the necessary concepts behind classical and quantum computing
  • Refresh and extend your grasp of essential mathematics, computing, and quantum theory
  • Explore the main applications of quantum computing to the fields of scientific computing, AI, and elsewhere
  • Examine a detailed overview of qubits, quantum circuits, and quantum algorithm

Quantum Computing in Practice with Qiskit® and IBM Quantum Experience®

Hassi Norlen

ISBN: 9781838828448

  • Visualize a qubit in Python and understand the concept of superposition
  • Install...