That's why you should work with the latest versions :) Check version 3.0-x, it has many interesting new features.
On Fri, Jun 11, 2010 at 4:14 PM, Руслан Жачук <[email protected]> wrote: > As far as I know there is no scheme like PDOS.kgridMonkhorstPack > implemented for PDOS also (at least in Siesta-2.0.2) > > > Ruslan > > > > 2010/6/11 Marcos Veríssimo Alves <[email protected]> > >> In principle. it should be the same. As far as I know, no scheme such as >> the PDOS.kgridMonkhorstPack is implemented for LDOS. although it shouldn't >> be too difficult to do it. >> >> Marcos >> >> >> On Fri, Jun 11, 2010 at 11:51 AM, Руслан Жачук <[email protected]> wrote: >> >>> Are they the same k-points as used for total energy calculation (SCF) ? >>> I.e. k-points specified in kgrid_Monkhorst_Pack ? >>> >>> Ruslan >>> >>> >>> >>> >>> >>> >>> >>> 2010/6/11 Marcos Veríssimo Alves <[email protected]> >>> >>> Ruslan >>>> >>>> It can do both. If you have a calculation with k-points it sums over >>>> them. Check local_DOS.F for details, but it's rather straightforward. >>>> >>>> Marcos >>>> >>>> On Thu, Jun 10, 2010 at 9:44 PM, Руслан Жачук <[email protected]>wrote: >>>> >>>>> Dear Siesta code developers, >>>>> >>>>> once I posted this question, but nobody answers. >>>>> >>>>> When calculating local density of states (LDOS) does Siesta count only >>>>> eigenstates at Gamma k-point or sums the states all over the Brillouin >>>>> zone??? >>>>> >>>>> I saw this question in mailing list, but also without answer. >>>>> >>>>> >>>>> Kind regrards >>>>> Ruslan Zhachuk >>>>> >>>> >>>> >>> >> >
