<div dir="ltr">Thanks a lot. :) <br><br>On Tuesday, 23 September 2014 12:33:13 UTC+2, jgh wrote:<blockquote class="gmail_quote" style="margin: 0;margin-left: 0.8ex;border-left: 1px #ccc solid;padding-left: 1ex;">Hi
<br>
<br>it should work, see examples in
<br>
<br>cp2k/tests/QMMM/SE/regtest
<br>cp2k/tests/QMMM/SE/regtest_2
<br>cp2k/tests/QMMM/SE/regtest-<wbr>force-mixing
<br>
<br>regards
<br>
<br>Juerg
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<br>Juerg Hutter <wbr> Phone : ++41 44 635 4491
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<br>From: Ravi Tripathi
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<br>Date: 09/23/2014 11:02AM
<br>Subject: [CP2K:5658] Semiempirical QMMM Calculation ?
<br>
<br>Dear CP2K users,
<br>
<br>Is it possible to perform a semiempirical QMMM calculation in CP2K?
<br>
<br>Thanks in advance
<br>
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