subject:"\[votca\] domain decomposition"

Re: [votca] domain decomposition

2016-07-25 Thread Chang Woon Jang

Dear Christoph, It is my misunderstanding during finding ways to solve the domain decomposition error on Stampede. Gromacs suggests optimizing the DD grids and choosing the proper ranks. When standalone mode is ok, I thought that log file might give me some clue about that. Therefore, I

Re: [votca] domain decomposition

2016-07-25 Thread Christoph Junghans

Can you explain, what the issue with csg_stat was please? Is there an error? 2016-07-25 12:25 GMT-06:00 Chang Woon Jang : > Dear Christoph, > >Thank you for your reply. Does it mean that I need to set up the > following like > > >--nt number > > > in the in xml