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Author Topic: passivation of dangling bonds  (Read 4022 times)

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Offline namrata

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passivation of dangling bonds
« on: October 25, 2009, 08:34 »
i wanted to know if there is some script to selectively passivate the dangling in the surface region of the electrodes ???
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Offline zh

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Re: passivation of dangling bonds
« Reply #1 on: October 26, 2009, 01:36 »
Please try to use the "Molecular Builder" module in VNL to selectively passivate the dangling bond. In particular, use the Geometry Manager tool.
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