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Current state of the art in TDDFT code


We present a TDDFT code developed in the framework of NOSSI project. The code is capable to compute absorption spectra in linear response regime. The method for calculating of the Kohn-Sham response function is outlined. Complexity of the method is discussed in detail. Testing of the shared memory parallelization and examples of spectra are given.
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inria-00437612 , version 1 (01-12-2009)


  • HAL Id : inria-00437612 , version 1


Petr Koval, Olivier Coulaud, Dietrich Foerster. Current state of the art in TDDFT code. NOSSI 2009 (annual meeting), Oct 2009, Biarritz, France. pp.40. ⟨inria-00437612⟩
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