Thomas Gunter Bates

2 Questions 3 Answers 0 Followers

Questions related from Thomas Gunter Bates

Can you model coordinate covalent bonds (dative bonds) on GaussView?

Good day I want to ask if it is possible to model coordinate covalent bonds on GaussView. I have already modelled NH3-BH3 on GaussView but I want to confirm if it was correct. What I did was...

26 December 2020 2,835 1 View

How to resolve Convergence Failure other than increasing SCF cycles in G09?

Good day people I'm trying to optimise a biphenyl with substituents on using DFT rB3LYP aug-cc-pVDZ. I optimised biphenyl on its own with no problems, but now I added substituents on it and now...

08 March 2019 4,065 4 View