Mechanistic studies and design of supported transition metal complexes od Gani, Terry Zhi Hao.

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Where Does the Density Localize? Convergent Behavior for Global Hybrids, Range Separation, and DFT+U od Gani, Terry Zhi Hao, Kulik, Heather Janine

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Understanding and Breaking Scaling Relations in Single-Site Catalysis: Methane to Methanol Conversion by Fe(IV)=O od Gani, Terry Zhi Hao, Kulik, Heather Janine

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Unifying Exchange Sensitivity in Transition-Metal Spin-State Ordering and Catalysis through Bond Valence Metrics od Gani, Terry Zhi Hao, Kulik, Heather Janine

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Computational Discovery of Hydrogen Bond Design Rules for Electrochemical Ion Separation od Gani, Terry Zhi Hao, Ioannidis, Efthymios Ioannis, Kulik, Heather Janine

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Leveraging Cheminformatics Strategies for Inorganic Discovery: Application to Redox Potential Design od Janet, Jon Paul, Gani, Terry Zhi Hao, Steeves, Adam H., Ioannidis, Efthymios Ioannis, Kulik, Heather Janine

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