Posted by Valera on June 19, 2013 at 12:09:39:
In Reply to: Stuck CASPT2 Calculation posted by Oscar on June 19, 2013 at 10:55:01:
How mach physical RAM do you have on the computer? and what is MOLCASMEM?
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if B is 1s22s22p1, what is Li?
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Comments: : How mach physical RAM do you have on the computer? and what is MOLCASMEM?