[Pw_forum] about the influence of lo-to split on the vibrational model
xu yuehua
njuxuyuehua at gmail.com
Mon Nov 19 08:36:19 CET 2007
hi everyone :
i am now computing ir-intensity.and in the input file, i add lo-to split
.and the result is that some vibration frequency is changed corresponding to
the *.dynG.
and my question is once adding lo-to split,does the vibrational model
including vibrational vector changed ?if it does ,how to get the changed
vector ,because i need to plot the graph about the mode .
maybe some of you could give me a piece of advise.
i need your help
thank you
--
Xu Yuehua
physics Department of Nanjing university
China
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