Re: [SIESTA-L] what kind of software do you use to construct the surface?

2010-01-11 Por tôpico min gao
Dear all, Thank you for your kind suggestion. I tried to install the GDIS,but failed. There is an error showing "This application has failed to start because libglib-2.0-0.dll was not found. Re-installing the application may fix the problem". While even I download the libglib-2.0-0.dll, the GDIS st

Re: [SIESTA-L] what kind of software do you use to construct the surface?

2010-01-07 Por tôpico gjgarcia
Hi Before to use SIESTA, I used Gaussian mainly. So, for me to use GaussView to construct my crystal is easy. I know about other program such Maestro, Molekel, gdis, Material Studio, Avogradro. I think that all is program are a bit difficult to use. Except Material Studio and GaussVieww, all are fr

Re: [SIESTA-L] what kind of software do you use to construct the surface?

2010-01-07 Por tôpico Herbert Fruchtl
Try gdis. It can directly read and write fdf files and can create a surface slab with given Miller indices. I don't know if you can create a crystal from scratch. http://sourceforge.net/projects/gdis/ More powerful, but text-based and clunky to use, is tetr. http://www.cmmp.ucl.ac.uk/~lev/codes

Re: [SIESTA-L] what kind of software do you use to construct the surface?

2010-01-07 Por tôpico Christopher Rowan
I personally use GaussView. Maestro is free, and good for molecules. But if you're only interested in crystal surfaces you could write your own code, say in fortran, to generate a periodic structure. Chris Rowan 2010/1/7 min gao > Dear all, > > I am learning the siesta now, while I still can

[SIESTA-L] what kind of software do you use to construct the surface?

2010-01-07 Por tôpico min gao
Dear all, I am learning the siesta now, while I still can not find a suitable software to construct the surface. Most of the softwares are charged,so is there some kind is free or cheap? what kind of software are you using for the siesta? Thank you very much Yours, Min Gao