ga get2eri: cannot allocate scr 2


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Hello everyone,

I met a question when I ran a program for dft optimize, The following is the reason why the program stops:


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ga_get2eri: cannot allocate scr 2
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current input line :
31: task qmmm dft optimize
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I just don't know how to solve the problem, maybe you can help me.

Thanks for your attention. Any suggestion will be appreciated.

Cui Wang