I have no idea how good/bad 3ddens is for STM. I know lapw5 works and agrees fairly well with experiment for insulators if you use reasonable values for the tip vibrations. (Ignoring tip vibrations leads to images with too high resolution.)
On Thu, Dec 6, 2018, 20:33 Lawal Mohammed <mohammedlawa...@yahoo.com> wrote: > Dear Developers and Users, > > I need some advice on using the 3ddens program. My interest is to simulate > STM image of a 3D system to compare with our experimental results. > My questions are: > > Whether it's possible for 3D system. > What determine the size of the grid points? > Do I have to edit any file in my case directory before x 3ddens -XX? > > I want to test run using TiC, what are the general tips? Any hint is > highly appreciated. > > Thanks a lot for your time. > > With kind regards. > > > *Lawal * >
_______________________________________________ Wien mailing list Wien@zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the MAILING-LIST at: http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html
