But in siesta (SpinPolarized T) means ferromagnetic which in turn means no
spins up and down will exist simultaneously because they all must be up or down
but not mixed.
On Sunday, August 16, 2015 10:43 AM, Nick Papior <[email protected]>
wrote:
They are spin-up/down.
2015-08-16 17:40 GMT+00:00 Jaret Qi <[email protected]>:
Can you please clarify how collinear spin relates to transiesta.
On Sunday, August 16, 2015 10:33 AM, Nick Papior <[email protected]>
wrote:
Same as siesta. Co-linear spin.
2015-08-16 16:32 GMT+00:00 Jaret Qi <[email protected]>:
Hello,,
I'm running spin polarized transport calculations for ZGNRs, so I got currents
for spin 1 and spin 2. My question: what these spins represent, are they spin
up and spin down?
As I know spin true in siesta means FM calculation which in turn means spins
are parallel or antiparallel, but not mixed.
Thank you
Jaret
On Wednesday, August 5, 2015 4:20 AM, leoqmc . <[email protected]> wrote:
Dear Nick,
Thank you for your reply.
Leone
2015-08-05 4:50 GMT-03:00 Nick Papior <[email protected]>:
I would say it is a little too much, but I think you should do convergence
tests (as noted in many of the previous answers).
2015-08-04 23:03 GMT+02:00 leoqmc . <[email protected]>:
Dear Nick, I had already seen this issue on the list but I have not found a
satisfactory answer to my question. Please provide me some guide.
Thank You Very Much.
Leone
2015-08-04 17:50 GMT-03:00 Nick Papior <[email protected]>:
Please read the many questions already posed about exactly this. --Kind regards
Nick PapiorOn 4 Aug 2015 21:13, "leoqmc ." <[email protected]> wrote:
Dear siesta/Transiesta users,
I am interested in transport calculations. My system consists of a molecule
between two gold surfaces. The calculation for scattering region (electrodes
plus molecule) ends normally. However, Qsol and Qtot looks like:
TranSiesta: Qsol,Qtot: 2634.554 2632.000 1.000
This difference is tolerable?
Thanks in Advance.
Leone
--
Kind regards Nick
--
Kind regards Nick
--
Kind regards Nick
