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<DIV>Dear,</DIV>
<DIV> I want to calculate antiferromagnetic coupling in two Mg-doped GaN. I don't know how to design the inst-file of Mg, since Mg has two 3s electrons. </DIV>
<DIV> I'll appreciated for receiving this answer!</DIV>
<DIV> </DIV>
<DIV> Best regards,</DIV>
<DIV> c w zhang</DIV>
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