Applications: Alkanes and cycloalkanes

  • Kjeld Rasmussen
Part of the Lecture Notes in Chemistry book series (LNC, volume 37)


This chapter will review some of our results obtained on the simpler compounds. I shall describe potential energy functions with parameter sets fitted both by trial and error and by optimisation, and I shall observe chronological order. The older parts include also work on ethers and alcohols.


Saddle Point Torsional Angle Crown Ether Rotational Constant Potential Energy Function 
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Copyright information

© Springer-Verlag Berlin Heidelberg 1985

Authors and Affiliations

  • Kjeld Rasmussen
    • 1
  1. 1.Chemistry DepartmentTechnical University of DenmarkLyngbyDenmark

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