Have you checked the end of the manual, where there are conversion factros for loads of units accpeted by Siesta?
On page http://www.icmab.es/siesta/manuales/manual-3.0-b/node111.html : energy K 1.38066E-23 J Marcos On Wed, Apr 21, 2010 at 2:03 PM, Henrik Löfås <[email protected]>wrote: > Hi Gregorio, > > My guess would be Kelvin, multiply by Boltzmann's constant and you get > J/ev. > > Cheers! > Henrik > > 2010/4/21 Gregorio García Moreno <[email protected]> > > Hi all >> My question is not directly related with SIESTA, but I am desperate, I do >> not know where Can I look for the answer. >> Who knows which is the equivalency for energy in K units? >> I have found a paper (in which SIESTA is used) wherein the units of energy >> in torsional barriers as expresed as Energy (K) relative to minimum. >> What is K energy? >> >> I need some help >> >> Thanks in advance >> > >
