[Wien] Curie temperature

2012-01-25 Thread shameem banu
Dear Wien2k users, Can we calculate the Curie temperature using Wien2k? If so how? Please this may be explained. For Cr, I can not find case.inst in the wien2k manual and I request that this may be sent so that I can compare with the one I got.Few more examples may also kindly be sent. Thank you

[Wien] Wien2k user and a subsciber, finding error while posting mail to this.

2008-08-21 Thread shameem banu
ket Error: 11001, Error Number: 0x800CCC0D ? Please guide me. ? shameem banu ? Wien2k user( beginner) Did you know? You can CHAT without downloading messenger. Go to http://in.webmessenger.yahoo.com/ -- next part -- An HTML attachment was scrubbed... URL: http://zeus.t

[Wien] modeling thin films

2010-02-04 Thread SHAMEEM BANU
Dear wien users, I would like to learn how to model thin films using Wiek2k. Can the wien2k users kindly guide me in this. Thank you. Dr.Shameem Banu Professor B.S.A.university India -- next part -- An HTML attachment was scrubbed... URL:

[Wien] electron density plot

2011-05-27 Thread shameem banu
Dear Prof. Blaha, I request you to kindly provide me the input for the electron density plot for the cubic structure along 100, 110 and 111 directions.Also?explain how to arrive at the?x-end and y-end details with respect to the origin. I shall be grateful to you if you answer me as soon as pos

[Wien] optical properties

2011-06-21 Thread SHAMEEM BANU
Dear WIEN2k users,I am using WIEN2k version 8. I am going to update to version 11.1.Using  version 8, I have come across several research publications. So I tried to calculate the optical propertiesof GaAs for which I used the structure file given by this version. After fixing RMT, I did init_l

[Wien] optical properties

2011-06-23 Thread shameem banu
should be ok. Check the details of the error in lapw2, maybe this helps further. Am 21.06.2011 13:52, schrieb SHAMEEM BANU: > Dear WIEN2k users, > > I am using WIEN2k version 8. I am going to update to version 11.1. > > Using version 8, I have come across several research publications.

[Wien] Installation of WIEN2K

2008-05-14 Thread shameem banu
Dear Dr.Peter Blaha, I would like to work WIEK2K in Federo Core 8 . What are the suitable intel compiler and MKL versions? Thank you for sparing your precious time. With regards DR.SHAMEEM BANU - Explore your hobbies and interests. Cli

[Wien] (no subject)

2008-05-23 Thread shameem banu
I would like to work WIEK2K in Federo Core 8 . What are the suitable intel compiler and MKL versions? Thank you for sparing your precious time. With regards DR.SHAMEEM BANU - Planet Earth is in the hot seat. Know more. --