Run 3
Oct 9, 2023this run was meant to be a sort of mock-forensics experiment. Sep 28, 2017can someone help with with setting up a calculation to run the new composite scheme pbeh-3c in gaussian? May 25, 2012also today it is quite common to have the dna stain already in the gel while the electrophoresis is running (instead of adding a staining solution at the end of the run).
Dec 1, 2016alternatively, if you are only interested in the frequencies, normal modes, and/or ir spectrum, you can edit the atomic masses in the .hess file after the run is completed and use the. Jan 19, 2017can anyone help me to run a geometry optimization and frequency calculation using b2plyp-d3 functional including the dft-d3 dispersion correction?