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Computational Quantum Physics and Chemistry of Nanomaterials

This Special Issue of Nanomaterials collects a series of original research articles providing new insight into the application of computational quantum physics and chemistry in research on nanomaterials. It illustrates the extension and diversity of the field and indicates some future directions. It...

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ग्रंथसूची विवरण
अन्य लेखक:	Šob, Mojmír (संपादक)
स्वरूप:	इलेक्ट्रोनिक पुस्तक अध्याय
भाषा:	अंग्रेज़ी
प्रकाशित:	Basel, Switzerland MDPI - Multidisciplinary Digital Publishing Institute 2021
विषय:	Research & information: general BTF TATB CL-20 cocrystal energetic materials shock sensitivity large-scale ab initio molecular dynamics simulations AlN low-dimensional material atomic cluster electronic structure HSE06 hybrid functional CsPbBr3 CsPb2Br5 solvent polarity CTAB phase transition high-entropy alloys generalized stacking fault energy first-principles interfacial energy surface energy nanoparticles gold ab initio molecular mechanics fcc Ni tilt Σ5(210) grain boundary vacancy Si and Al impurity grain boundary energy segregation energy defects binding energies magnetism ferroelectricity SnTe nanoribbon nanoflakes critical size density-functional theory thermodynamics silver decahedron excess energy ab initio calculations dye-sensitized solar cells azobenzene density functional theory topological insulators magnetic doping defects environment and health first-principles physics DFT hazardous gas n/a
ऑनलाइन पहुंच:	DOAB: download the publication DOAB: description of the publication
टैग:	टैग जोड़ें कोई टैग नहीं, इस रिकॉर्ड को टैग करने वाले पहले व्यक्ति बनें!

समान संसाधन

Quantum Mechanical/Molecular Mechanical Approaches for the Investigation of Chemical Systems - Recent Developments and Advanced Applications
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प्रकाशित: (2018)

First-Principles Prediction of Structures and Properties in Crystals
द्वारा: Kurzydlowski, Dominik
प्रकाशित: (2019)

Ultraschnelle zeitaufgelöste Pump/Probe-Photoelektronenspektroskopie an isolierten und massenselektierten Anionen
द्वारा: Ehrler, Oli T.
प्रकाशित: (2006)

New Frontiers in Multiscale Modelling of Advanced Materials
द्वारा: Simone Taioli
प्रकाशित: (2016)

Berechnung von Raman-Intensitäten mit zeitabhängiger Dichtefunktionaltheorie
द्वारा: Rappoport, Dmitrij
प्रकाशित: (2007)

Thermochemistry and Kinetics for the Oxidative Degradation of Dibenzofuran and Precursors
द्वारा: Sebbar, Nadia
प्रकाशित: (2006)

High-Pressure Studies of Crystalline Materials
प्रकाशित: (2018)

Numerical Modeling of Materials under Extreme Conditions
प्रकाशित: (2023)

First-Principles Approaches to Metals, Alloys, and Metallic Compounds
द्वारा: Richard Dronskowski (Ed.)
प्रकाशित: (2018)

Modeling and Experimental Characterization of Nanocomposite Materials
द्वारा: Hadavinia, Homayoun
प्रकाशित: (2020)

Advanced Magnetic Nanocomposites Structural, Physical Properties and Application
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Application of Optimization Algorithms in Chemistry
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Pressure-Induced Phase Transformations (Volume II)
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Diffusionseigenschaften von Nickel in einer Festoxid-Brennstoffzelle
द्वारा: Haremski, Patricia
प्रकाशित: (2022)

Diffusionseigenschaften von Nickel in einer Festoxid-Brennstoffzelle
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प्रकाशित: (2022)

Organic Optoelectronics: Photoelectronic Conversion Materials, Physics and Devices
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Wireless Power Transfer Recent Development, Applications and New Perspectives
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Ab Initio Language Teaching in British Higher Education The Case of German
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Ab Initio Language Teaching in British Higher Education The Case of German
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Recent Advances in Novel Materials for Future Spintronics
द्वारा: Wang, Xiaotian
प्रकाशित: (2019)

Livius und der Leser
द्वारा: Dennis Pausch
प्रकाशित: (2011)

Global Wheat Production
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Intermetallic Compound (Volume II)
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História, Histórias e Paradoxografia: Opera Omnia
द्वारा: Reina Marisol Troca Pereira
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An Enquiry into the Truth of the Tradition, Concerning the Discovery of America, by Prince Madog ab Owen Gwynedd, about the Year, 1170
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Energy Harvesters and Self-powered Sensors for Smart Electronics
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Energy and Sustainable Futures Proceedings of 2nd ICESF 2020 /
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Ice Crystals
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Energy and Sustainable Futures Proceedings of 2nd ICESF 2020
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Energy and Sustainable Futures Proceedings of 2nd ICESF 2020
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Energy Saving at Cities
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Energy in the Americas; Energy in the Americas Critical Reflections on Energy and History; Critical Reflections on Energy and History
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Energy in the Americas; Energy in the Americas Critical Reflections on Energy and History; Critical Reflections on Energy and History
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Vulnerable Households in the Energy Transition Energy Poverty, Demographics and Policies
प्रकाशित: (2023)

Vulnerable Households in the Energy Transition Energy Poverty, Demographics and Policies
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Proceedings of the Australian Summer Study on Energy Productivity
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Proceedings of the Australian Summer Study on Energy Productivity
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Adaptive Middleware for the Internet of Things The GAMBAS Approach
द्वारा: Handte, Marcus
प्रकाशित: (2018)

Silicon-Germanium Heterojunction Bipolar Transistors for Mm-wave Systems Technology, Modeling and Circuit Applications
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Circuit Design Anticipate, Analyze, Exploit Variations
द्वारा: Weber, Stephan
प्रकाशित: (2017)