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 Quantum chemical calculations
  • Quantum chemical calculations
  • Quantum chemical calculations are indispensable for researchers worldwide. The accurate prediction of properties like conformational energies, cluster structures, excited states, transition states and dipoles are used in a broad variety of applications. 

    TURBOMOLE is our fast and reliable quantum chemistry package, already used to optimize and deliver the best catalysts for chemical reactions, understand and improve organic light emitting diodes (OLEDs) or predict spectra as general aid to compound synthesis and analytical tasks.


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