[Wien] Non-collinear spin structure

2012-04-19 Thread Hena Das
From: wien-bounces at zeus.theochem.tuwien.ac.at [wien-bounces at zeus.theochem.tuwien.ac.at] on behalf of Peter Blaha [pbl...@theochem.tuwien.ac.at] Sent: Wednesday, April 18, 2012 3:41 PM To: A Mailing list for WIEN2k users Subject: Re: [Wien] Non-collinear spin structure Of course you need

[Wien] Non-collinear spin structure

2012-04-18 Thread Hena Das
Dear Wien2k developers and users, My aim is to do a total energy calculation for a particular non-collinear spin arrangement including spin-orbit interaction. Can you please tell me how to input the initial non-collinear spin arrangement? Do I need to use Wienncm? Thank you. Hena Das

[Wien] Non-collinear spin structure

2012-04-18 Thread Peter Blaha
Of course you need wienncm for this. Am 18.04.2012 21:16, schrieb Hena Das: Dear Wien2k developers and users, My aim is to do a total energy calculation for a particular non-collinear spin arrangement including spin-orbit interaction. Can you please tell me how to input the initial