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Materials Chemistry

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Physical Chemistry

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Kelly M. Hunter

5 results in Authors: Kelly M. Hunter

Materials Chemistry

Monitoring water harvesting in metal-organic frameworks, one water molecule at a time

Kelly M. Hunter, Francesco Paesani

Version 1 posted 01 December 2023

136

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Physical Chemistry

Simulation Meets Experiment: Unraveling the Properties of Water in Metal-Organic Frameworks Through Vibrational Spectroscopy

Kelly M. Hunter, Jackson Wagner, Mark Kalaj, Wei Xiong, Paesani Lab, Francesco Paesani

Version 1 posted 06 April 2021

424

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Physical Chemistry

Neither Solid Nor Liquid Nor Vapor: Hydrogen Bonding Structure of Water Confined in Metal-Organic Frameworks with Open Metal Sites

Adam Rieth, Kelly M. Hunter, Mircea Dinca, Paesani Lab

Version 1 posted 02 May 2019

800

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Physical Chemistry

Disentangling Coupling Effects in the Infrared Spectra of Liquid Water

Kelly M. Hunter, Farnaz A. Shakib, Paesani Lab

Version 1 posted 12 October 2018

837

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Theoretical and Computational Chemistry

The Anomalies and Local Structure of Liquid Water from Boiling to the Supercooled Regime as Predicted by the Many-Body MB-pol Model

Thomas E. Gartner III, Kelly M. Hunter, Eleftherios Lambros, Alessandro Caruso, Marc Riera, Gregory R. Medders, Athanassios Z. Panagiotopoulos, Pablo G. Debenedetti, Francesco Paesani

Version 2 posted 25 February 2022

1,114

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