Recent content by Vellaboy89
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Material Studio (geometry optimization)
FYI, I got the structure of the compound directly from Cambridge Crystallographic Database.- Vellaboy89
- Post #2
- Forum: MATLAB, Maple, Mathematica, LaTeX
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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...- Vellaboy89
- Thread
- Chemical engineering Energy Material Optimization
- Replies: 2
- Forum: MATLAB, Maple, Mathematica, LaTeX