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Dissociation of H2CO3

William Decker

Hello Colleagues,

I have been trying to format a run of the dissociation of H2CO3 into H20 and CO2 for the past several days and have been unsuccessful in my attempts.

I've tried running an IRC run from the saddle point of my H2CO3 run.  
I would run a surface scan in order to force the molecules apart but I have been unable to create the H2CO3 transition point where the H from one oxygen attaches to the second OH group and then detaches.  

Thanks for your help.

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