Recent content by Vellaboy89

  1. V

    Material Studio (geometry optimization)

    FYI, I got the structure of the compound directly from Cambridge Crystallographic Database.
  2. V

    Material Studio (geometry optimization)

    Hi. I am using Material Studio (MS) version 4.3 (yeah I know it's old but that's all I've got) and I have been trying to calculate this energy of a specific compound (N,N-dimethylformamide). I've learned that there are 3 ways on how to calculate energy using MS; Forcite, Dmol3 and Minimizer...
Back
Top