Thanks for replying! I'm using version 1.4-dev gitid: c825a67, the last lines of inverse.log talk about an error:
initialize_step_genericsim.sh: initial_configuration 'folder' not implemented Folder is where I downloaded the files from the spce tutorial. I've checked that that script is present in the same folder as csg_inverse.sh, should it be somewhere else? El martes, 3 de mayo de 2016, 19:20:52 (UTC+2), Christoph Junghans escribió: > > > On 5/3/16, 10:23, "Jose Emilio Ruiz Navarro" <[email protected] > <javascript:>> > > wrote: > > > >>Hello, > >> > >>I'm using one of the csg tutorials > >>(https://github.com/votca/csg-tutorials/tree/master/spce/ibi_lammps) > for > >>my masters thesis, but when I run it I just get a single line in the > >>terminal saying "Terminated" and nothing happens. I downloaded all the > >>files in that folder and LAMMPS works correctly when I use it (maybe > >>VOTCA can't run it properly?). Other VOTCA programs like csg_boltzmann > >>work just fine so I guess they were properly compiled. Am I missing > >>something? Could you help me, please? > Welcome! > > Try the following things: > 0.) Which version of VOTCA are you using? (see csg_call --version) > 1.) Have a look at the last 100 lines of the log file (usually > inverse.log). What does it say? > 2.) You can go into step_001 and run the simulation manually to see > what happens. > $ cd step_001 > $ lmp -in spce.in > > Cheers, > > Christoph > > >> > >>Best, > >> > >>Emilio R > > > > > > -- > Christoph Junghans > Web: http://www.compphys.de > -- You received this message because you are subscribed to the Google Groups "votca" group. To unsubscribe from this group and stop receiving emails from it, send an email to [email protected]. To post to this group, send email to [email protected]. Visit this group at https://groups.google.com/group/votca. For more options, visit https://groups.google.com/d/optout.
