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 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 >>> >>> > -- Kind regards Nick
