[SIESTA-L] The high symmetry points of silicene nanoribbon

you very much. zhiyong wang

Re: [SIESTA-L] what's the Qsol

Dear wei: qc0 may refer to the beginning , and qcn0 may refer to the end of the computation qc0 : 0.000 qcn0 : 456.635 2010/5/31 jw wei > > > > > Dear All: > There are four quantities (qc0, qcn0，Qsol,Qtot) about electric charge > in transiesta calculation(shown as following)

Re: [SIESTA-L] Transiesta calculation

Dear Mehmet Topsakal: Thank you very much for reply! I will follow your advice! zhiyong

Re: [SIESTA-L] how to get the magnetic moment of one system by siesta?

Dear Marcos: Thank you very much for reply! zhiyong

Re: [SIESTA-L] how to get the magnetic moment of one system by siesta?

Dear Gul Rahman: Thank you very much for reply,and I will follow your advice ! zhiyong

Re: [SIESTA-L] Transiesta calculation

Dear SIESTA users: I also get the following error: Done ERROR: lastoL,NGL2 0 13 26 39 15 ERROR: Unexpected no. orbs. in L elec. ERROR STOP from Node:0 I am looking forward to your reply! my input.fdf is attached

Re: [SIESTA-L] how to get the magnetic moment of one system by siesta?

Dear ricardo: Thank you very much for your reply,I have performed a spin-polarized calculation by setting" SpinPolarized T %block DM.InitSpin 5 + 48 - %endblock DM.InitSpin " but I don't know how to get the magnetic moment,please give me some

[SIESTA-L] how to get the magnetic moment of one system by siesta?

Dear all siesta users: I want to get the magnetic moment of one system, but I don't know how to set the parameters! can you give some advices? thank you in advance. I am looking forward to your reply! zhiyong