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 Papior
> On 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
>>
>>

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