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The notation n -point water model indicates the number of sites explicitly included to model water-water interactions. Each model has a single Lennard-Jones site center on the water oxygen. The three-point models place electrostatic charges on the water oxygen and hydrogen sites. The four-point models place positive charges on the water hydrogens and a negative charge point along the dipole, slightly ahead of the water oxygen. The five-point models place positive charges on the water hydrogens and negative charges on the lone pair sites.
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The notation n -point water model indicates the number of sites explicitly included to model water-water interactions. Each model has a single Lennard-Jones site center on the water oxygen. The three-point models place electrostatic charges on the water oxygen and hydrogen sites. The four-point models place positive charges on the water hydrogens and a negative charge point along the dipole, slightly ahead of the water oxygen. The five-point models place positive charges on the water hydrogens and negative charges on the lone pair sites.
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