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White Papers and Technical Notes

  • Modeling Antiferromagnetic Coupling in Gaussian 09 
  • Transition State Optimizations with Opt=QST2 
  • Using the CI-Singles Method to Model Excited States of Highly Symmetric Molecules 
  • Using Gaussian to Teach Physical Chemistry
  • Comparing NMR Methods in ChemDraw and Gaussian
  • Vibrational Analysis in Gaussian
  • Thermochemistry in Gaussian 
  • Visualizing Results when Gaussian and GaussView are on Different Machines
  • Studying Chirality with Vibrational Circular Dichroism
  • Investigating the Reactivity and Spectra of Large Molecules with ONIOM

 

Last update: 23 April 2013