Zoekresultaten - "density functional theory"

Nanomaterials Based Gas Sensors for SF6 Decomposition Components Detection

Onderwerpen: “…carbon nanotubes, density functional theory, graphene, adsorption, sensing mechanism…”
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Fullerenes and Relative Materials Properties and Applications

Onderwerpen: “…carbon nanotubes, density functional theory, raman spectroscopy, friction, fragmentation, singlet oxygen…”
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The Role of Non-Stoichiometry in the Functional Properties of Oxide Materials

Onderwerpen: “…Density Functional Theory…”
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Phonons in Low Dimensional Structures

Onderwerpen: “…carbon nanotube, density functional theory, raman spectroscopy, monte carlo simulation, piezoelectric, elastic properties…”
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First-Principles Approaches to Metals, Alloys, and Metallic Compounds door Richard Dronskowski (Ed.)

Onderwerpen: “…density-functional theory…”
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Quantum Mechanical/Molecular Mechanical Approaches for the Investigation of Chemical Systems - Recent Developments and Advanced Applications door Sam P. de Visser

Onderwerpen: “…Density Functional Theory…”
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Zweikomponentige Methoden im Rahmen der zeitabhängigen Dichtefunktionaltheorie - Theorie, Implementierung und Anwendung door Kühn, Michael

Onderwerpen: “…Time-dependent density functional theory…”
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Electrocatalysis in Fuel Cells door Minhua Shao (Ed.)

Onderwerpen: “…density functional theory…”
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Synthesis, Properties and Applications of Germanium Chalcogenides

Onderwerpen: “…density functional theory…”
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Synthesis and Applications of Copper-Based Catalysts

Onderwerpen: “…density functional theory…”
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Computational Quantum Physics and Chemistry of Nanomaterials

Onderwerpen: “…density-functional theory…”
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Carbon Ligands From Fundamental Aspects to Applications

Onderwerpen: “…density functional theory…”
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Cornerstones in Contemporary Inorganic Chemistry

Onderwerpen: “…density functional theory…”
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New Concepts in Oxidation Processes door Genty, Eric

Onderwerpen: “…density functional theory calculation…”
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Photocatalytic Hydrogen Evolution

Onderwerpen: “…density-functional theory…”
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First-Principles Prediction of Structures and Properties in Crystals door Kurzydlowski, Dominik

Onderwerpen: “…density functional theory…”
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Molecular Electronics

Onderwerpen: “…density functional theory…”
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Crystal Structures of Metal Complexes

Onderwerpen: “…density functional theory (DFT)…”
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Commemorative Issue in Honor of Professor Karlheinz Schwarz on the Occasion of His 80th Birthday

Onderwerpen: “…density functional theory…”
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High-Pressure Physical and Chemical Behaviors of Minerals and Rocks

Onderwerpen: “…density functional theory…”
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