From markm@portal.vpharm.com  Wed Dec  2 10:08:48 1992
From: markm@portal.vpharm.com (Mark Murcko)
Message-Id: <9212022008.AA03436@portal.vpharm.com>
Subject: D2O parameters for MD and MC simulations
To: chemistry@ccl.net
Date: Wed, 2 Dec 92 15:08:48 EST


Does anyone know of any parameters for D2O that have been optimized
for periodic boundary simulations?  In other words, a D2O model that
can reproduce the heat capacity, density, heat of vaporization, etc.
for heavy water.  I've done some literature searching and have come
up dry.  Thanks!

/ Mark