A Ligand Field Molecular Mechanics Study of CO2‐Induced Breathing in the Metal–Organic Framework DUT‐8(Ni) von Melix, Patrick, Paesani, Francesco, Heine, Thomas

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London Dispersion Governs the Interaction Mechanism of Small Polar and Nonpolar Molecules in Metal–Organic Frameworks von Melix, Patrick, Heine, Thomas

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Investigation of CO2 Orientational Dynamics through Simulated NMR Line Shapes von Melix, Patrick, Heine, Thomas

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Single-Step Selective Oxidation of Methane by Iron-Oxo Species in the Metal–Organic Framework MFU-4l von Melix, Patrick, Snurr, Randall Q.

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Investigation of CO 2 Orientational Dynamics through Simulated NMR Line Shapes von Melix, Patrick, Heine, Thomas

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Air-Stable Cu(I) Metal–Organic Framework for Hydrogen Storage von Sengupta, Debabrata, Melix, Patrick, Bose, Saptasree, Duncan, Joshua, Wang, Xingjie, Mian, Mohammad Rasel, Kirlikovali, Kent O., Joodaki, Faramarz, Islamoglu, Timur, Yildirim, Taner, Snurr, Randall Q., Farha, Omar K.

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Fine-Tuning a Robust Metal–Organic Framework toward Enhanced Clean Energy Gas Storage von Chen, Zhijie, Mian, Mohammad Rasel, Lee, Seung-Joon, Chen, Haoyuan, Zhang, Xuan, Kirlikovali, Kent O, Shulda, Sarah, Melix, Patrick, Rosen, Andrew S, Parilla, Philip A, Gennett, Thomas, Snurr, Randall Q, Islamoglu, Timur, Yildirim, Taner, Farha, Omar K

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Conformational isomerism controls collective flexibility in metal-organic framework DUT-8(Ni) von Petkov, Petko St, Bon, Volodymyr, Hobday, Claire L, Kuc, Agnieszka B, Melix, Patrick, Kaskel, Stefan, Düren, Tina, Heine, Thomas

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Conformational isomerism controls collective flexibility in metal-organic framework DUT-8(Ni) von Petkov, Petkov, Bon, Volodymyr, Hobday, Claire, Kruc, Agnieszka, Melix, Patrick, Kaskel, Stefan, Düren, Tina, Heine, Thomas

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A Ligand Field Molecular Mechanics Study of CO 2 ‐Induced Breathing in the Metal–Organic Framework DUT‐8(Ni) von Melix, Patrick, Paesani, Francesco, Heine, Thomas

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Interfacial Unit-Dependent Catalytic Activity for CO Oxidation over Cerium Oxysulfate Cluster Assemblies von Wasson, Megan C., Wang, Xingjie, Melix, Patrick, Alayoglu, Selim, Wolek, Andrew T. Y., Colliard, Ian, Son, Florencia A., Xie, Haomiao, Weitz, Eric, Islamoglu, Timur, Nyman, May, Snurr, Randall Q., Notestein, Justin M., Farha, Omar K.

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Spin polarization in SCC-DFTB von Melix, Patrick, Oliveira, Augusto Faria, Rüger, Robert, Heine, Thomas

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Dataset for "Single-Step Selective Oxidation of Methane by Iron-Oxo Species in the Metal-Organic Framework MFU-4l" von Melix, Patrick

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Dataset for "Structural Linkage Unit-Dependent Catalytic Activity for CO Oxidation over Cerium Oxysulfate Cluster Assemblies" von Melix, Patrick

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Sulfidation of a metal-organic framework via heterolytic splitting of organo sulfides at distorted Zr-nodes von Melix, Patrick, Formalik, Filip

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Investigation of CO2 Orientational Dynamics through Simulated NMR Line Shapes von Melix, Patrick

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London Dispersion Governs the Interaction Mechanism of Small Polar and Non-Polar Molecules in Metal-Organic Frameworks von Melix, Patrick

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Dataset for "An air-stable Cu(I) metal-organic framework for hydrogen storage" von Melix, Patrick, Joodaki, Faramarz

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A Ligand Field Molecular Mechanics Study of CO2 Induced Breathing in the metal-organic framework DUT-8(Ni) von Melix, Patrick

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Dataset for "Fine-Tuning A Robust Metal–Organic Framework Towards Enhanced Clean Energy Gas Storage" von Chen, Haoyuan, Rosen, Andrew, Melix, Patrick, Snurr, Randall Q.

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