Dear Dr. Mattioli, I will do the calculation for different spin configurations and will let you know as soon as I have the results. And regarding the "subject" I am sorry to change that, I did that by mistake and did not realize.
On Tue, Jul 26, 2011 at 7:01 PM, Giuseppe Mattioli < giuseppe.mattioli at mlib.ism.cnr.it> wrote: > > Dear Mohnish > changing the subject will not produce automatically an answer... I suspect > that you are asking something that deserves itself a full investigation. > Let > us know the results. > Yours > Giuseppe > > On Tuesday 26 July 2011 12:03:57 mohnish pandey wrote: > > Dear QE users, > > > > I want to do calculations of thin films of antiferromagnetic oxide like > > CoO. The CoO has rocksalt structure and magnetization along (111) > > direction. Suppose we take 3 layers and 4 layers for of CoO along (111), > > then my doubt is that will the magnetization oscillate i.e. in even > number > > of layers it will be zero and odd number of layers will have some finite > > value? Or wil the film will show antiferrromagnetism in plane i.e. every > > layers of CoO will be antiferromagnetic? And what about other directions > > like (001) or (10-10) in wurtzite structure. > > > > Thanks a lot in advance for help.. > > > > -- > ******************************************************** > - Article premier - Les hommes naissent et demeurent > libres et ?gaux en droits. Les distinctions sociales > ne peuvent ?tre fond?es que sur l'utilit? commune > - Article 2 - Le but de toute association politique > est la conservation des droits naturels et > imprescriptibles de l'homme. Ces droits sont la libert?, > la propri?t?, la s?ret? et la r?sistance ? l'oppression. > ******************************************************** > > Giuseppe Mattioli > CNR - ISTITUTO DI STRUTTURA DELLA MATERIA > v. Salaria Km 29,300 - C.P. 10 > I 00015 - Monterotondo Stazione (RM) > Tel + 39 06 90672836 - Fax +39 06 90672316 > E-mail: <giuseppe.mattioli at ism.cnr.it> > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://www.democritos.it/mailman/listinfo/pw_forum > -- Regards, MOHNISH, ----------------------------------------------------------------- Mohnish Pandey Senior Project Associate, Department of Chemical Engineering, IIT KANPUR, UP, INDIA ----------------------------------------------------------------- -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20110727/92e7eb71/attachment.htm
