Revisiting the Polyol Synthesis of Silver Nanostructures: Role of Chloride in Nanocube Formation von Chen, Zhifeng, Balankura, Tonnam, Fichthorn, Kristen A, Rioux, Robert M

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How Structure-Directing Agents Control Nanocrystal Shape: Polyvinylpyrrolidone-Mediated Growth of Ag Nanocubes von Qi, Xin, Balankura, Tonnam, Zhou, Ya, Fichthorn, Kristen A

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Mechanisms of Oriented Attachment of TiO2 Nanocrystals in Vacuum and Humid Environments: Reactive Molecular Dynamics von Raju, Muralikrishna, van Duin, Adri C. T, Fichthorn, Kristen A

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Obtaining the solid-liquid interfacial free energy via multi-scheme thermodynamic integration: Ag-ethylene glycol interfaces von Qi, Xin, Zhou, Ya, Fichthorn, Kristen A.

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Microscopic View of Nucleation in the Anatase-to-Rutile Transformation von Zhou, Ya, Fichthorn, Kristen A

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ReaxFF Reactive Force Field Study of the Dissociation of Water on Titania Surfaces von Raju, Muralikrishna, Kim, Sung-Yup, van Duin, Adri C. T, Fichthorn, Kristen A

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Theory of Anisotropic Metal Nanostructures von Fichthorn, Kristen A.

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Atomic-Scale Theory and Simulations for Colloidal Metal Nanocrystal Growth von Fichthorn, Kristen A

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A Theory for the Morphological Dependence of Wetting on a Physically Patterned Solid Surface von Shahraz, Azar, Borhan, Ali, Fichthorn, Kristen A

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A Force Field for Describing the Polyvinylpyrrolidone-Mediated Solution-Phase Synthesis of Shape-Selective Ag Nanoparticles von Zhou, Ya, Saidi, Wissam A, Fichthorn, Kristen A

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Synthesis of {111}-Faceted Au Nanocrystals Mediated by Polyvinylpyrrolidone: Insights from Density-Functional Theory and Molecular Dynamics von Liu, Shih-Hsien, Saidi, Wissam A, Zhou, Ya, Fichthorn, Kristen A

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Solution-Phase Growth of Cu Nanowires with Aspect Ratios Greater Than 1000: Multiscale Theory von Kim, Junseok, Cui, Jianming, Fichthorn, Kristen A

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Structural classification of Ag and Cu nanocrystals with machine learning von Zhang, Huaizhong, Fichthorn, Kristen A

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Minimum Free-Energy Shapes of Ag Nanocrystals: Vacuum vs Solution von Yan, Tianyu, Zhang, Huaizhong, Fichthorn, Kristen A.

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Shapes and Shape Transformations of Solution-Phase Metal Particles in the Sub-nanometer to Nanometer Size Range: Progress and Challenges von Fichthorn, Kristen A, Yan, Tianyu

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Dynamic Contact Angles and Mechanisms of Motion of Water Droplets Moving on Nanopillared Superhydrophobic Surfaces: A Molecular Dynamics Simulation Study von Li, Hao, Yan, Tianyu, Fichthorn, Kristen A, Yu, Sirong

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Molecular View of Polymer/Water Interfaces in Latex Paint von Li, Zifeng, Yuan, Fang, Fichthorn, Kristen A, Milner, Scott T, Larson, Ronald G

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Influence of Gravity on the Sliding Angle of Water Drops on Nanopillared Superhydrophobic Surfaces von Li, Hao, Yan, Tianyu, Fichthorn, Kristen A

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OptiBoost: A method for choosing a safe and efficient boost for the bond-boost method in accelerated molecular dynamics simulations with hyperdynamics von Cui, Jianming, Fichthorn, Kristen A.

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Single-Crystal Electrochemistry Reveals Why Metal Nanowires Grow von Kim, Myung Jun, Alvarez, Samuel, Chen, Zihao, Fichthorn, Kristen A, Wiley, Benjamin J

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