July 09 - Database Meeting
After two weeks of not having a meeting for the work done in databases
, we had it finally this friday. There were several updates in the scripts, specially with those realted to the upgrades made in the new fix
command.
These additions in the code will help us restart or fix broken calculations. Of course, the first step is to identify possible problems with Gaussian through the output reported into the log
and fchk
files.
There was a very useful discussion about work advanced by Abdul, Julianna, Hasan, Maxilian and me on our respective databases. It was a long but fruitful meeting. It helped me to solve many of the doubts that I had, specially those regardin alkalides
and Li/Na/K/Rb
clusters. Now it's time to end the week and keep up the work.