Dear Nick, I have understood it. Now only I have checked. Thanks a lot.
On Tue, Jun 28, 2016 at 1:59 PM, Nick Papior <nickpap...@gmail.com> wrote: > Please follow this site for the trunk version > https://launchpad.net/siesta > Currently, 526 is the latest version. > > 2016-06-28 10:24 GMT+02:00 Anju Saroha <anju....@gmail.com>: > >> Dear Nick, >> >> In my knowledge, siesta-trunk-515 is the latest version. Is there any >> version latest than this? >> >> Thanks and regards >> >> On Tue, Jun 28, 2016 at 12:26 PM, Nick Papior <nickpap...@gmail.com> >> wrote: >> >>> Could you please try the latest trunk version, there have been certain >>> fixes for the LDA+U implementation. >>> >>> If siesta still exhibits an error, please follow the steps explained >>> here: >>> https://answers.launchpad.net/siesta/+faq/2779 >>> >>> >>> 2016-06-27 21:18 GMT+02:00 Anju Saroha <anju....@gmail.com>: >>> >>>> Dear siesta users, >>>> >>>> I have installed siesta-trunk-515 using intel-check make file in >>>> Src/Sys. >>>> *It is running without any error when I am not using U (Hubbard >>>> parameter) but the moment I am giving the U parameter, it's aborting with >>>> an error shown below. * >>>> Can someone please help me in resolving the issue? I have tried all >>>> possible ways I knew but I am not having any further clue. >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> >>>> *POLgen: Perturbative polarization orbital with L= 1POLgen: >>>> Polarization orbital for state 4s izeta = 1 rc = >>>> 4.912997 energy = 0.139983 kinetic = >>>> 0.923750 potential(screened) = -0.783767 potential(ionic) = >>>> -6.360530atom: Total number of Sankey-type orbitals: 15atm_pop: Valence >>>> configuration (for local Pseudopot. screening): 4s( >>>> 2.00) 4p( >>>> 0.00) 3d( >>>> 6.00) Vna: >>>> chval, zval: 8.00000 8.00000Vna: Cut-off radius for the neutral-atom >>>> potential: 4.912997atom: >>>> _________________________________________________________________________ldau_proj_gen: >>>> PAO cut-off radius determined from anldau_proj_gen: energy shift = >>>> 0.050000 Ryldau_proj_gen: rco = 3.060618 Bohrforrtl: error (65): floating >>>> invalidImage PC Routine >>>> Line Source siesta >>>> 00000000006C2897 Unknown Unknown >>>> Unknownsiesta 00000000004CC843 Unknown >>>> Unknown Unknownsiesta 00000000005B4514 >>>> Unknown Unknown Unknownsiesta >>>> 0000000000DEFF27 Unknown Unknown >>>> Unknownsiesta 000000000040411C Unknown >>>> Unknown Unknownlibc.so.6 00007F0CDA0B7C36 >>>> Unknown Unknown Unknownsiesta >>>> 0000000000404019 Unknown Unknown Unknown* >>>> >>>> >>>> Here I am *attaching the arch.make file*. >>>> >>>> I am looking forward for a help. Thanks in advance. >>>> >>>> Regards >>>> >>>> -- >>>> Anju Saroha >>>> Research Scholar >>>> Department of Physics >>>> IIT Madras >>>> Chennai-600036 >>>> India. >>>> >>>> >>>> >>> >>> >>> -- >>> Kind regards Nick >>> >> >> >> >> -- >> Anju Saroha >> Research Scholar >> Prof. M. S. Ramachandra Rao and >> Dr. B. Ranjit Kumar Nanda's group >> Department of Physics >> IIT Madras >> Chennai-600036 >> >> >> > > > -- > Kind regards Nick > -- Anju Saroha Research Scholar Prof. M. S. Ramachandra Rao and Dr. B. Ranjit Kumar Nanda's group Department of Physics IIT Madras Chennai-600036
