Alexandru Stoicu

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Questions related from Alexandru Stoicu

How does one determine the type of electronic transition listed for an excited state calculation?

Gaussian09D: After an excited state computation has finished, the requested excited states are listed along with the atomic orbital transitions that are supposedly taking place during the...

21 June 2016 827 4 View

How do I generate a vibrational-rotational spectra in the THz region using Gaussian09!?

Hello everybody! I'm trying to obtain the vibrational-rotational spectra (in the THz region) for a structure, using Gaussian09 and GaussView. From what I understand, using the freq=vibrot and...

17 April 2015 6,955 4 View