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Birth of NaCl Crystals: Insights from Molecular Simulations

The journal of physical chemistry. B, 2016-09, Vol.120 (34), p.9076-9087

2016

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How Crystals Nucleate and Grow in Aqueous NaCl Solution

The journal of physical chemistry letters, 2013-02, Vol.4 (4), p.573-578

2013

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Using machine learning with atomistic surface and local water features to predict heterogeneous ice nucleation

The Journal of chemical physics, 2024-03, Vol.160 (12)

2024

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Unraveling the Mechanism of Ice Nucleation by Mica (001) Surfaces

Journal of physical chemistry. C, 2021-12, Vol.125 (48), p.26927-26941

2021

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How Microscopic Features of Mineral Surfaces Critically Influence Heterogeneous Ice Nucleation

Journal of physical chemistry. C, 2021-05, Vol.125 (19), p.10723-10737

2021

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Simulated conduction rates of water through a (6,6) carbon nanotube strongly depend on bulk properties of the model employed

The Journal of chemical physics, 2016-05, Vol.144 (18), p.184502-184502

2016

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Simulations of water structure and the possibility of ice nucleation on selected crystal planes of K-feldspar

The Journal of chemical physics, 2019-06, Vol.150 (21), p.214501-214501

2019

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Ice Nucleation by the Primary Prism Face of Silver Iodide

Journal of physical chemistry. C, 2022-04, Vol.126 (15), p.6716-6723

2022

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Simulations of Ice Nucleation by Kaolinite (001) with Rigid and Flexible Surfaces

The journal of physical chemistry. B, 2016-03, Vol.120 (8), p.1726-1734

2016

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Simulations of water transport through carbon nanotubes: how different water models influence the conduction rate

The Journal of chemical physics, 2014-11, Vol.141 (18), p.18C518-18C518

2014

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Molecular Dynamics Simulation of NaCl Dissolution

The journal of physical chemistry. B, 2015-03, Vol.119 (11), p.4275-4283

2015

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A molecular dynamics investigation of the influence of water structure on ion conduction through a carbon nanotube

The Journal of chemical physics, 2017-02, Vol.146 (7), p.074502-074502

2017

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The Mechanism of Heterogeneous Ice Nucleation by Fatty Alcohol Monolayers

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2024-08, Vol.128 (34), p.7214-7225

2024

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Why α‑Alumina Is an Effective Ice Nucleus

Journal of physical chemistry. C, 2019-10, Vol.123 (43), p.26424-26431

2019

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Aggregation in dilute aqueous tert-butyl alcohol solutions: insights from large-scale simulations

The Journal of chemical physics, 2012-07, Vol.137 (3), p.034509-034509

2012

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Influence of pH on Ice Nucleation by Kaolinite: Experiments and Molecular Simulations

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2022-12, Vol.126 (49), p.9227-9243

2022

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Effects of Inorganic Ions on Ice Nucleation by the Al Surface of Kaolinite Immersed in Water

The journal of physical chemistry. B, 2020-06, Vol.124 (22), p.4605-4618

2020

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Molecular Dynamics Simulations of Ice Nucleation by Electric Fields

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2012-07, Vol.116 (26), p.7057-7064

2012

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Fluctuations and local ice structure in model supercooled water

The Journal of chemical physics, 2015-09, Vol.143 (9), p.094504-094504

2015

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Understanding the Structure Factor and Isothermal Compressibility of Ambient Water in Terms of Local Structural Environments

The journal of physical chemistry. B, 2012-10, Vol.116 (39), p.12014-12020

2012

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Binary salt structure classification with convolutional neural networks: Application to crystal nucleation and melting point calculations

The Journal of chemical physics, 2022-11, Vol.157 (20), p.204108-204108

2022

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An analysis of fluctuations in supercooled TIP4P/2005 water

The Journal of chemical physics, 2013-05, Vol.138 (18), p.184502-184502

2013

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Simulations of Ice Nucleation by Model AgI Disks and Plates

The journal of physical chemistry. B, 2016-03, Vol.120 (9), p.2291-2299

2016

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Comparison of simulation and experimental results for a model aqueous tert-butanol solution

The Journal of chemical physics, 2017-07, Vol.147 (2), p.024503-024503

2017

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Crystal structures of model lithium halides in bulk phase and in clusters

The Journal of chemical physics, 2017-04, Vol.146 (15), p.154501-154501

2017

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Birth of NaCl Crystals: Insights from Molecular Simulations

How Crystals Nucleate and Grow in Aqueous NaCl Solution

Using machine learning with atomistic surface and local water features to predict heterogeneous ice nucleation

Unraveling the Mechanism of Ice Nucleation by Mica (001) Surfaces

How Microscopic Features of Mineral Surfaces Critically Influence Heterogeneous Ice Nucleation

Simulated conduction rates of water through a (6,6) carbon nanotube strongly depend on bulk properties of the model employed

Simulations of water structure and the possibility of ice nucleation on selected crystal planes of K-feldspar

Ice Nucleation by the Primary Prism Face of Silver Iodide

Simulations of Ice Nucleation by Kaolinite (001) with Rigid and Flexible Surfaces

Simulations of water transport through carbon nanotubes: how different water models influence the conduction rate

Molecular Dynamics Simulation of NaCl Dissolution

A molecular dynamics investigation of the influence of water structure on ion conduction through a carbon nanotube

The Mechanism of Heterogeneous Ice Nucleation by Fatty Alcohol Monolayers

Why α‑Alumina Is an Effective Ice Nucleus

Aggregation in dilute aqueous tert-butyl alcohol solutions: insights from large-scale simulations

Influence of pH on Ice Nucleation by Kaolinite: Experiments and Molecular Simulations

Effects of Inorganic Ions on Ice Nucleation by the Al Surface of Kaolinite Immersed in Water

Molecular Dynamics Simulations of Ice Nucleation by Electric Fields

Fluctuations and local ice structure in model supercooled water

Understanding the Structure Factor and Isothermal Compressibility of Ambient Water in Terms of Local Structural Environments

Binary salt structure classification with convolutional neural networks: Application to crystal nucleation and melting point calculations

An analysis of fluctuations in supercooled TIP4P/2005 water

Simulations of Ice Nucleation by Model AgI Disks and Plates

Comparison of simulation and experimental results for a model aqueous tert-butanol solution

Crystal structures of model lithium halides in bulk phase and in clusters

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