Author Topic: confused on the spin value(relative)  (Read 3222 times)

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Offline fanjiaping

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confused on the spin value(relative)
« on: April 3, 2011, 14:18 »
Dear sir :     
      in the initial module of the scripter panel, We can set the spin value(relative) of each atom. the value range from -1 to 1. But my confusion is what is the value stand for? My understanding on the meaning of value which set to 1 or -1 is all the unpaired electrons directed to one direction.And the value equal to 0.5 means half of the unpaired electrons directed to one direction. If my understanding is right, my problem is when someone set the value to 0.77, how does  the software work?
        thanks for any advices!

Offline Anders Blom

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Re: confused on the spin value(relative)
« Reply #1 on: April 3, 2011, 21:02 »