2nd Year Course

Theoretical Methods for Chemists

Computational Laboratories


MRes and 4th Year Course

The Theory of Nanoscale Structures: Computer Simulations and Modelling

Slides from Lectures - Autumn Term

Further Reading

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  • A. Szabo & N.S. Ostlund, Modern quantum chemistry, Macmillan, New-York, 1982.
  • R. Dreizler, E. Gross, Density Functional Theory. (Plenum Press, New York, 1995)
  • R. G. Parr, W. Yang, Density-Functional Theory of Atoms and Molecules. (OUP, New York, 1989)
  • "Magnetism - Fundamentals", Chapters 7, 8, and 9, Ed. E. du Tremolet de Lacheisserie, D. Gignoux, M. Schlenker, Grenoble Sciences, (Springer, 2005) : NB: Classmark 538MAG in ICL Libraries

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Background

download keygen quiz creator xin key crack youcam 6 This course assumes a basic familiarity with quantum mechanics as presented in a typical physics or chemistry undergraduate level. The following may be useful background reading. 

  • RP Feynman, RB. Leighton and M. Sands. The Feynman Lectures on Physics Vol 3, Addison-Wesley (1965)
  • PW Atkins and RS Friedman, Molecular Quantum Mechanics, 4th Ed, (OUP, 2004)