44 citations · 61 across the 3 of their papers we have counts for
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physics.chem-ph2011★ 16 cited
Water coordination structures and the excess free energy of the liquid
Safir Merchant, Jindal K. Shah, D. Asthagiri
For a distinguished water molecule, the solute water, we assess the contribution of each coordination state to its excess chemical potential, using a molecular aufbau approach. In…
physics.chem-ph2007★ 44 cited
Balancing Local Order and Long-Ranged Interactions in the Molecular Theory of Liquid Water
J. K. Shah, D. Asthagiri, L. R. Pratt +1
A molecular theory of liquid water is identified and studied on the basis of computer simulation of the TIP3P model of liquid water. This theory would be exact for models of liquid…