Comment 1 for bug 1630849

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Nick Papior (nickpapior) wrote :

For which kind of MD calculations are you experiencing this?

Please note that DM_history_depth gets reset to another value in this routine:

subroutine get_allowed_history_depth

in m_new_dm.

Hence, e.g. for the Tests/sih the DM is reused after each MD-step. Although the number of steps can't be controlled.

The logic in the m_new_dm code is under revision and indeed the intent is that DM_history_depth can be set by the user.