AMBER Archive (2009)

Subject: [AMBER] DFT SK parameter for P atom

From: Qizhi Cui (
Date: Mon Feb 02 2009 - 13:59:19 CST


I am using AMBER10 to run QM/MM simulation. I would like to use DFTB
theory and our system contains phosphate atom (P). We have downloaded
DFTB SK parameter files (mio-0-1) from But we cannot find
the parameter file for P atom. Does the current DFTB support P atom? If
so, where to get the SK parameter?


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