Ondrej Certik wrote: > > Since my research topis is electronic structure calculations, I took > the most famous electronic structure program abinit.org, which is in > fortran, I replaced their build system with cmake, installed it into > Sage, wrote Python wrappers that produce input files and read output > files from it, installed it to Sage and here is how it looks like: > > http://nb.hpfem.org/home/pub/7/ > > Now I need to play with graphics, e.g. create plots from all the > programs that I am interested in and then it will start to rock. Then > I'll try to interface all the other programs too.
I'm curious: is there any chance that you'll use JMOL as a 3d molecular viewer? I've been curious about any uses in Sage of JMOL for its original intended purpose. Please note that the default menu for JMOL changed in 3.3, but that it's very easy to get the old menu back. The old menu showed lots of stuff that is very nice to have if you are actually looking at atoms and molecules. Thanks, Jason --~--~---------~--~----~------------~-------~--~----~ To post to this group, send email to sage-devel@googlegroups.com To unsubscribe from this group, send email to sage-devel-unsubscr...@googlegroups.com For more options, visit this group at http://groups.google.com/group/sage-devel URLs: http://www.sagemath.org -~----------~----~----~----~------~----~------~--~---
