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Author Topic: Optimization at RI-MP2-F12 level  (Read 4688 times)

tayed

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Optimization at RI-MP2-F12 level
« on: November 07, 2011, 05:02:19 PM »
Hi every body,


I want to do a single point calculations by using different values of distance, can anybody send me an input showing how can introduce the scan?

Thanks in advance

 
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