Simple transferable intermolecular potential for the molecular simulation of water over wide ranges of state conditions

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Department of Chemical Engineering, 419 Dougherty Engineering Building, University of Tennessee, Knoxville, TN 37996-2200, United States [1 ]
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Fluid Phase Equilibria | 1998年 / 150卷 / 151期
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This work was supported by the Division of Chemical Sciences; Office of Basic Energy Sciences; U.S. Department of Energy. Computations reported in this work were performed on IBM RS/6000 in the Computational Laboratory for Environmental Biotechnology in the Department of Chemical Engineering at the University of Virginia; and on the IBM SP/2 of the Computing and Administrative Systems at the University of Tennessee. The IBM SP/2 was obtained under the IBM Shared University Resource program;
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页码:73 / 81
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