Molecular orbital theory book reccomenations

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SUMMARY

The discussion focuses on recommendations for learning molecular orbital theory, emphasizing the need for resources covering single-electron systems, many-electron systems, and the Born-Oppenheimer approximation. Key suggestions include "Physical Chemistry" by Peter Atkins, which is recognized for its comprehensive coverage, and "Modern Quantum Chemistry: Introduction to Advanced Electronic Structure Theory" by Szabo, a Dover publication noted for its affordability. The user seeks free online resources but is open to borrowing textbooks if necessary.

PREREQUISITES
  • Understanding of single-electron systems
  • Knowledge of many-electron systems
  • Familiarity with the Born-Oppenheimer approximation
  • Basic concepts of quantum chemistry
NEXT STEPS
  • Research free online resources for molecular orbital theory
  • Explore "Physical Chemistry" by Peter Atkins for in-depth study
  • Investigate "Modern Quantum Chemistry" by Szabo for advanced electronic structure theory
  • Look into borrowing options for recommended textbooks
USEFUL FOR

Chemistry students, educators, and anyone interested in deepening their understanding of molecular orbital theory and quantum chemistry.

etotheipi
Hey guys, I decide I need to learn the mathematics of molecular-orbital theory, to build on the qualitative approach of my chemistry coursee. To do this I also first need to study single-electron systems and then many-electron systems, the Born-Oppenheimer approximation, and relevant topics therein.

I'm not really in a position to buy a textbook right now, so I hoped someone would be able to suggest a free online resource which will cover these? But if anyone recommends a nice textbook then I'll be very pleased to look into that as well, though I won't be able to try and borrow it for at least a few weeks [and I'd quite like to get started on something tomorrow!].

Thanks! :smile:
 
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Atkins seems to cover several of these topics and it is often considered to be the physical chemistry textbook.
 
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Sorry I don't know of any websites to recommend, but you might take a look at Szabo - Modern Quantum Chemistry: Introduction to Advanced Electronic Structure Theory. It is a Dover publication, so should be very affordable.
 
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Interesting! Atkins looks great, but it might be a little overkill to splash out on such a beast of a textbook right now. I hadn't heard of Szabo, but that looks fun too. I need to check if either is available to borrow. Thanks for the suggestions 😄
 

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