| 6:34:11 PM PST - Sat, Mar 1st 2014 |
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oniom giving charge and multiplicity of real and model
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I am trying to run oniom job. I need to give different total charge for full/real system and for model system and I need to give the multiplicity for both of them. My job is running "perfectly" without giving
the total charges and multiplicities. But, when I am trying to introduce charges and multiplicities my job is not running. My question: could you give me the correct keywords of charges and multiplicities and their place. when I put keywords "charge 0" and "mult 2" into model line doesn't work.
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