Yes I am: KBM (VDW optB88-vdW of J.Klimes et al, JPCM 22, 022201 (2009)).
[]'s, @mps On Mon, Jan 6, 2014 at 1:34 PM, Nick Papior Andersen <[email protected]>wrote: > Are you using the vdW functional? > > Kind regards Nick > > > 2014/1/6 I. Camps <[email protected]> > > Dear SIESTers, >> >> I am performing a cell optimization and I am getting the error (4 times >> at the end of my log file): >> >> mesh3D initTask ERROR: parameter maxTasks too small >> >> I already changed the value of maxTasks in the mesh3D.F90 file, >> unsuccessfully (I do not know if this values are ok). >> >> integer,parameter:: maxDistr = 1000 ! Max. number of mesh >> distributions >> ! allocated at any given time >> integer,parameter:: maxTasks = 1000 ! Max. number of communication >> tasks >> ! allocated at any given time >> integer,parameter:: maxDistrID = 1000 ! Max. IDs assigned to the same >> distrib. >> integer,parameter:: maxTaskID = 1000 ! Max. IDs assigned to the same >> task >> integer,parameter:: maxParts = 125 ! Max. parts of a mesh box >> integer,parameter:: maxDistrTasks = 1000 ! Max. communication tasks >> associated >> ! to a parallel mesh >> distribution >> >> Any ideas about how to solve this error? >> >> Regards, >> >> Camps >> > > > > -- > Kind regards Nick >
