Search Results - "density functional theory"

Recent Trends in Catalysis for Syngas Production and Conversion

Subjects: “…density functional theory…”
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Process Systems Engineering Tools for the Design of Ionic Liquids and Integrated Biorefineries

Subjects: “…density functional theory…”
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Surface Engineering & Coating Technologies for Corrosion and Tribocorrosion Resistance

Subjects: “…density functional theory (DFT)…”
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Chemical Bond and Intermolecular Interactions

Subjects: “…density functional theory…”
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Zeolites as Catalysts: Applications in Chemical Engineering, Energy Sources and Environmental Protection

Subjects: “…density functional theory (DFT)…”
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Removal of Organic Pollution in Water Environment by Kotowska, Urszula

Subjects: “…density functional theory…”
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The Application of Quantum Mechanics in Reactivity of Molecules

Subjects: “…porphyrins, density functional theory…”
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Recent Advances in Iron Catalysis

Subjects: “…density functional theory…”
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Calixarene Complexes: Synthesis, Properties and Applications

Subjects: “…density functional theory…”
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Properties of Transition Metals and Their Compounds at Extreme Conditions

Subjects: “…density-functional theory…”
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Electrocatalysts for Oxygen/Hydrogen-Involved Reactions

Subjects: “…density functional theory…”
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Amide Bond Activation by Szostak, Michal

Subjects: “…density functional theory…”
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Novel Photoactive Materials by Diamanti, Maria Vittoria

Subjects: “…density functional theory (DFT)…”
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2D Materials and Van der Waals Heterostructures Physics and Applications

Subjects: “…density functional theory…”
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Cyclodextrin Chemistry and Toxicology

Subjects: “…density functional theory (DFT)…”
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Modeling, Design and Optimization of Multiphase Systems in Minerals Processing by Cisternas, Luis A.

Subjects: “…density functional theory…”
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Thin Films for Energy Harvesting, Conversion, and Storage by Zhao, Xin

Subjects: “…density functional theory…”
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Transition Metals in Catalysis The Functional Relationship of Fe-S Clusters and Molybdenum or Tungsten Cofactor-Containing Enzyme Systems

Subjects: “…density functional theory…”
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Gulliver in the Country of Lilliput An Interplay of Noncovalent Interactions

Subjects: “…density functional theory…”
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Electron and Photon Interactions with Bio(Related) Molecules

Subjects: “…time-dependent density functional theory…”
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