Equilibrium Structure of Free Molecules : Theory, Experiment, and Data Analysis / / by Natalja Vogt, Jean Demaison |
Autore | Vogt Natalja |
Edizione | [1st ed. 2023.] |
Pubbl/distr/stampa | Cham : , : Springer International Publishing : , : Imprint : Springer, , 2023 |
Descrizione fisica | 1 online resource (482 pages) |
Disciplina | 541.22 |
Altri autori (Persone) | DemaisonJean |
Collana | Lecture Notes in Chemistry |
Soggetto topico |
Quantum chemistry
Atomic structure Molecular structure Molecular spectroscopy Electrons - Diffraction Instrumental analysis Spectrum analysis Quantum Chemistry Atomic and Molecular Structure and Properties Molecular Spectroscopy Diffraction Spectroscopy |
ISBN | 3-031-36045-1 |
Formato | Materiale a stampa |
Livello bibliografico | Monografia |
Lingua di pubblicazione | eng |
Nota di contenuto | Introduction -- Quantum Chemical Methods -- Rovibrational Spectroscopy and Structure of Diatomic Molecules -- Rotational Constants of a Polyatomic Molecule -- Equilibrium Structures of Semirigid Molecules from the Rotational Constants -- Structure of Nonrigid Molecules by Spectroscopic Methods -- Equilibrium Molecular Structure as Determined by Gas-phase Electron Diffraction -- Other Methods, Mainly for the X–H bond (X = C, N, O) -- Database with Equilibrium Structures of Free Molecules. |
Record Nr. | UNINA-9910770270803321 |
Vogt Natalja | ||
Cham : , : Springer International Publishing : , : Imprint : Springer, , 2023 | ||
Materiale a stampa | ||
Lo trovi qui: Univ. Federico II | ||
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Forcefields for Atomistic-Scale Simulations: Materials and Applications / / edited by Akarsh Verma, Sanjay Mavinkere Rangappa, Shigenobu Ogata, Suchart Siengchin |
Edizione | [1st ed. 2022.] |
Pubbl/distr/stampa | Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2022 |
Descrizione fisica | 1 online resource (395 pages) |
Disciplina | 531.6 |
Collana | Lecture Notes in Applied and Computational Mechanics |
Soggetto topico |
Materials science - Data processing
Molecular dynamics Nanotechnology Atomic structure Molecular structure Microclusters Atomistic Models Molecular Dynamics Atomic and Molecular Structure and Properties Atomic and Molecular Clusters |
ISBN | 981-19-3092-9 |
Formato | Materiale a stampa |
Livello bibliografico | Monografia |
Lingua di pubblicazione | eng |
Nota di contenuto | 1. Introduction to Forcefields -- 2. Forcefields for characterization of metals/metal alloys -- 3. Forcefields for characterization of nuclear materials -- 4. Forcefields and Atomistic insights to study high entropy alloys -- 5. Coarse-grained forcefields for anisotropically interacting particles -- 6. Forcefields for 2D nanomaterials (Graphene and h-BN) and the universal solvent “water” -- 7. Reactive forcefield (ReaxFF) for the combustion application -- 8. Reactive forcefield (ReaxFF) for the 2D nanomaterials synthesis -- 9. Forcefields and Modelling of Polymer Coatings and nanocomposites -- 10. Accelerated reactive forcefields for studying nanomaterials and polymers. |
Record Nr. | UNINA-9910588596303321 |
Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2022 | ||
Materiale a stampa | ||
Lo trovi qui: Univ. Federico II | ||
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Fundamentals of ⁵⁷Fe Mössbauer Spectrometry / / by R. Justin Joseyphus, Jean-Marc Greneche |
Autore | Joseyphus R. Justin |
Edizione | [1st ed. 2024.] |
Pubbl/distr/stampa | Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2024 |
Descrizione fisica | 1 online resource (XIV, 476 p. 259 illus., 216 illus. in color.) |
Disciplina | 537.5352 |
Soggetto topico |
Solid state physics
Materials - Analysis Spectrum analysis Atomic structure Molecular structure Nanoscience Electronic Devices Characterization and Analytical Technique Spectroscopy Atomic and Molecular Structure and Properties Nanophysics |
ISBN | 981-9986-53-2 |
Formato | Materiale a stampa |
Livello bibliografico | Monografia |
Lingua di pubblicazione | eng |
Nota di contenuto | 1. The Nucleus -- 2. Introduction to Quantum Mechanics -- 3. Introduction to Quantum Mechanics -- 4. The Mössbauer Effect -- 5. The Mössbauer Parameters. . |
Record Nr. | UNINA-9910864191903321 |
Joseyphus R. Justin | ||
Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2024 | ||
Materiale a stampa | ||
Lo trovi qui: Univ. Federico II | ||
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Handbook of Macrocyclic Supramolecular Assembly / / edited by Yu Liu, Yong Chen, Heng-Yi Zhang |
Edizione | [1st ed. 2020.] |
Pubbl/distr/stampa | Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2020 |
Descrizione fisica | 1 online resource (1098 illus., 848 illus. in color. eReference.) |
Disciplina | 547 |
Soggetto topico |
Chemistry, Organic
Medicinal chemistry Physical chemistry Biophysics Atomic structure Molecular structure Organic Chemistry Medicinal Chemistry Physical Chemistry Atomic and Molecular Structure and Properties |
ISBN | 981-15-2686-9 |
Formato | Materiale a stampa |
Livello bibliografico | Monografia |
Lingua di pubblicazione | eng |
Nota di contenuto | Section 1. Supramolecular Assemblies Based on Crown Ethers and Cyclophanes -- Chapter 1. Water-Soluble Aromatic Crown Ethers: from Molecular Recognition to Molecular Assembly -- Chapter 2. Polypseudorotaxanes Constructed by Crown Ethers -- Chapter 3. Host-Guest Chemistry of A Macrocycle Containing p Systems Namely Cyclobis(paraquat-p-phenylene) -- Chapter 4. Mechanically Selflocked Molecules -- Chapter 5. Photo-luminescent Crown Ether Assembly. Section 2. Supramolecular Assemblies Based on Macrocyclic Arenes -- Chapter 1. Triptycene Derived Macrocyclic Arenes: from Calixarenes to Helicarenes -- Chapter 2. General Introduction of Some Emerging Macrocyclic Arenes Related to Calixarenes and Pillararenes -- Chapter 3. Macrocyclic Amphiphiles for Nanomedicine -- Chapter 4. Preparation of Biosensor Based on Supermolecular Recognizaiton -- Chapter 5. Application of Anion-Pi Interaction on Supramolecular Self-Assembly -- Chapter 6. Functional Rotaxanes: from Synthetic Methodology to Functional Molecular Materials -- Chapter 7. Biphen[n]arenes: Synthesis and Host-Guest Properties -- Chapter 8. Pillararene-based Supramolecular Polymer. Section 3. Supramolecular Assemblies Based on Cyclodextrins -- Chapter 1. Functionalized Cyclodextrins and Their Applications -- Chapter 2. Cyclodextrin Polyrotaxanes: Synthesis, Analytics and Functions -- Chapter 3. Cyclodextrin Hybrid Inorganic Nanocomposites for Molecular Recognition, Selective Adsorption and Drug Delivery -- Chapter 4. Photoresponsive Supramolecular Assembly with Biological Function -- Chapter 5. Cyclodextrin-based Supramolecular Hydrogel -- Chapter 6. Supramolecular Chiral Photochemistry -- Chapter 7. Construction and Functions of Supramolecular Cyclodextrin Polymer -- Chapter 8. Construction of Cyclodextrin-based Magnetic Supramolecular Assemblies and Its Regulation of Cell Mobility -- Chapter 9. Supramolecular Assemblys Based on Multi-Charge Cyclodextrin Induced Aggregation. Section 4. Supramolecular Assemblies Based on Cucurbiturils -- Chapter 1. Stimuli Responsive Self-Assembly Based on Macrocyclic Hosts and Biomedical Applications -- Chapter 2. Modulation of Chemical and Biological Properties of Biomedically Relevant Guest Molecules by Cucurbituril-type Hosts -- Chapter 3. Self-Assembled Two-Dimensional Organic Layers in Solution Phase -- Chapter 4. Modified Cucurbiturils with Various Ring Size: Synthesis -- Chapter 5. Modified Cucurbiturils with Various Ring Size: Assembly -- Chapter 6. Modified Cucurbiturils with Various Ring Size: Functions -- Chapter 7. Biological Systems Involving Cucurbituril -- Chapter 8. Cucurbituril-based Pseudorotaxanes and Rotaxanes -- Chapter 9. Construction of Supramolecular Networks Based on CB8. Section 5. Supramolecular Assemblies Based on Other Macrocycles -- Chapter 1. Supramolecular Catalysis Using Functional Organic Macrocycles and Molecular Cages -- Chapter 2. Porphyrins and Porphyrinoids: Syntheses, Structures, and Properties -- Chapter 3. Protein Self-Assembly: Strategies and Applications -- Chapter 4. Peptide Tectonics: towards Biomimetic and Bioinspired Soft Materials -- Chapter 5. Naphthol-based Macrocycles -- Chapter 6. Carbohydrate-based Macromolecular Self-Assembly -- Chapter 7. in vivo Self-Assembly of Polypeptide-based Nanomaterials -- Chapter 8. Construction of Well-Defined Discrete Metallacycles and Their Biological Applications. Section 6. Some Important Approaches in Macrocycle-based Supramolecular Chemistry -- Chapter 1. Molecular Simulations of Supramolecular Architectures -- Chapter 2. Thermodynamic Studies of Supramolecular Systems -- Chapter 3. Spectral Studies of Supramolecular Systems -- Chapter 4. Artificial Host Molecules Modifying Biomacromolecules -- Chapter 5 Controllable Synthesis of Polynuclear Metal Clusters within Macrocycles -- Chapter 6 Integrating Macrocyclic Rings into Functional 3D Printing Materials -- Chapter 7 Molecular Recognition with Helical Receptors -- Chapter 8 Supramolecular Interface for Biochemical Sensing Applications -- Chapter 9 Supramolecular Functional Complexes Constructed by Orthogonal Self-Assembly -- Chapter 10 Aggregation Induced Emission of Macrocycle-based Assemblies -- Chapter 11 Application of Rare Earth Metal Complexes in Macrocycle-based Assemblies -- Chapter 12 Two Dimensional Supramolecular Framwork Based on Host-Guest Self-Assembly. Section 7. Biological Applications -- Chapter 1. Theranostic Supramolecular Vesicle Systems -- Chapter 2. Host–Guest Sensing by Nanopores and Nanochannels -- Chapter 3. Highly Selective Ultrafast Proton Transport by Synthetic Unimolecular Proton Channels -- Chapter 4.Drug/Gene Delivery Platform Based on Supramolecular Interactions: Hyaluronic Aicd and Folic Acid as Targeting Units -- Chapter 5. Self-Assembling Peptides for Vaccine Development and Antibody Production -- Chapter 6. Supramolecules Assisted Transport of Ions and Molecules through Lipid Bilayers -- Chapter 7. Construction and Biomedical Applications of Macrocycle-based Supramolecular Topological Polymers -- Chapter 8. Supermolecules as Medicinal Drugs -- Chapter 9. Nanoscaled Cyclodextrin Supermolecular System for Drug and Gene Delivery -- Chapter 10. Immunity Regulation by Cyclodextrin-based Supramolecular Assembly -- Chapter 11. Industrial Application of Cyclodextrin. |
Record Nr. | UNINA-9910416142003321 |
Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2020 | ||
Materiale a stampa | ||
Lo trovi qui: Univ. Federico II | ||
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Intrinsic Structures and Properties of Energetic Materials / / by Chaoyang Zhang, Jing Huang, Rupeng Bu |
Autore | Zhang Chaoyang |
Edizione | [1st ed. 2023.] |
Pubbl/distr/stampa | Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2023 |
Descrizione fisica | 1 online resource (469 pages) |
Disciplina | 530.411 |
Altri autori (Persone) |
HuangJing
BuRupeng |
Soggetto topico |
Condensed matter
Atomic structure Molecular structure Materials science—Data processing Surfaces (Physics) Structure of Condensed Matter Atomic and Molecular Structure and Properties Computational Materials Science Surface and Interface and Thin Film |
ISBN | 981-9926-99-8 |
Formato | Materiale a stampa |
Livello bibliografico | Monografia |
Lingua di pubblicazione | eng |
Nota di contenuto | Introduction -- Classification of Energetic Crystals -- Application of molecular simulation methods in treating intrinsic structures of energetic materials -- Energetic molecules & single-component energetic molecular crystals -- Polymorphism and polymorphic transition in energetic molecular crystals -- Energetic ionic crystals -- Energetic cocrstals -- Energetic atomic crystals, energetic metallic crystals & energetic mixed-type crystals -- Hydrogen bonding, hydrogen transfer and halogen bonding -- π-stacking in energetic crystals -- Crystal engineering for creating low sensitive and highly energetic materials. . |
Record Nr. | UNINA-9910734884503321 |
Zhang Chaoyang | ||
Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2023 | ||
Materiale a stampa | ||
Lo trovi qui: Univ. Federico II | ||
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microRNA: Basic Science : From Molecular Biology to Clinical Practice / / edited by Gaetano Santulli |
Edizione | [1st ed. 2015.] |
Pubbl/distr/stampa | Cham : , : Springer International Publishing : , : Imprint : Springer, , 2015 |
Descrizione fisica | 1 online resource (265 p.) |
Disciplina | 572.88 |
Collana | Advances in Experimental Medicine and Biology |
Soggetto topico |
Cytology
Atomic structure Molecular structure Biochemistry Medicine—Research Biology—Research Human physiology Cell Biology Atomic and Molecular Structure and Properties Chemical Biology Biomedical Research Human Physiology |
ISBN | 3-319-22380-1 |
Formato | Materiale a stampa |
Livello bibliografico | Monografia |
Lingua di pubblicazione | eng |
Record Nr. | UNINA-9910298449103321 |
Cham : , : Springer International Publishing : , : Imprint : Springer, , 2015 | ||
Materiale a stampa | ||
Lo trovi qui: Univ. Federico II | ||
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microRNA: Medical Evidence : From Molecular Biology to Clinical Practice / / edited by Gaetano Santulli |
Edizione | [1st ed. 2015.] |
Pubbl/distr/stampa | Cham : , : Springer International Publishing : , : Imprint : Springer, , 2015 |
Descrizione fisica | 1 online resource (428 p.) |
Disciplina | 572.88 |
Collana | Advances in Experimental Medicine and Biology |
Soggetto topico |
Medicine—Research
Biology—Research Cytology Atomic structure Molecular structure Biochemistry Human physiology Biomedical Research Cell Biology Atomic and Molecular Structure and Properties Chemical Biology Human Physiology |
ISBN | 3-319-22671-1 |
Formato | Materiale a stampa |
Livello bibliografico | Monografia |
Lingua di pubblicazione | eng |
Nota di contenuto | -- 1) microRNA and personalized medicine -- 2) microRNA and chronic pain -- 3) microRNA and multiple sclerosis -- 4) microRNA and epilepsy -- 5) microRNA and autism -- 6) microRNAs and fragile X syndrome -- 7) microRNAs and neurodegenerative disorders -- 8) microRNA and metabolism: focus on mitochondria -- 9) microRNA in cerebrovascular diseases -- 10) microRNA and cardiac regeneration -- 11) microRNA and arterial -- 12) microRNA and pulmonary hypertension . - 13) microRNA and diabetic kidney disease -- 14) MicroRNA and kidney transplantation -- 15) microRNA and wound healing -- 16) microRNA in dermatology -- 17) microRNA and allergy -- 18) Endometriosis -- 19) microRNA role in human -- 20) microRNA and hepatitis B -- 21) BIO microRNA and aging -- 22) microRNA and doping -- 23) microRNA profiling. |
Record Nr. | UNINA-9910298451703321 |
Cham : , : Springer International Publishing : , : Imprint : Springer, , 2015 | ||
Materiale a stampa | ||
Lo trovi qui: Univ. Federico II | ||
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Molecular Spectroscopy—Experiment and Theory : From Molecules to Functional Materials / / edited by Andrzej Koleżyński, Magdalena Król |
Edizione | [1st ed. 2019.] |
Pubbl/distr/stampa | Cham : , : Springer International Publishing : , : Imprint : Springer, , 2019 |
Descrizione fisica | 1 online resource (529 pages) : illustrations |
Disciplina | 539.6 |
Collana | Challenges and Advances in Computational Chemistry and Physics |
Soggetto topico |
Spectrum analysis
Materials - Analysis Atomic structure Molecular structure Chemistry, Physical and theoretical Spectroscopy Characterization and Analytical Technique Atomic and Molecular Structure and Properties Theoretical Chemistry |
ISBN | 3-030-01355-3 |
Formato | Materiale a stampa |
Livello bibliografico | Monografia |
Lingua di pubblicazione | eng |
Nota di contenuto | Introduction to spectroscopy -- Computational methods in spectroscopy -- Computational modeling of nanosystems -- Photophysical properties of chromophores -- Nonlinear optical properties of molecular-like metal nanoclusters -- Luminescence properties of materials -- Structural properties of magnetic ceramic materials -- Spectroscopic studies of surfaces and interfaces -- Spectroscopic methods as a tool for catalysis -- Spectroscopy in earth sciences -- Vibrational spectroscopy of aluminosilicates -- Spectroscopic characterization of amorphous materials -- Organosilicates – structure and properties -- Structure of “black” glasses by means of spectroscopic methods -- Vibrational spectroscopy in the analysis of biological systems -- Organic materials characterization -- Spectroscopy in the analysis of artworks. |
Record Nr. | UNINA-9910337932103321 |
Cham : , : Springer International Publishing : , : Imprint : Springer, , 2019 | ||
Materiale a stampa | ||
Lo trovi qui: Univ. Federico II | ||
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Physics and Applications of Hydrogen Negative Ion Sources / / edited by Marthe Bacal |
Edizione | [1st ed. 2023.] |
Pubbl/distr/stampa | Cham : , : Springer International Publishing : , : Imprint : Springer, , 2023 |
Descrizione fisica | 1 online resource (622 pages) |
Disciplina | 546.2 |
Collana | Springer Series on Atomic, Optical, and Plasma Physics |
Soggetto topico |
Plasma (Ionized gases)
Surfaces (Physics) Particle accelerators Atomic structure Molecular structure Plasma Physics Surface and Interface and Thin Film Accelerator Physics Atomic and Molecular Structure and Properties |
Soggetto non controllato |
Chemistry
Science |
ISBN | 9783031214769 |
Formato | Materiale a stampa |
Livello bibliografico | Monografia |
Lingua di pubblicazione | eng |
Nota di contenuto | Chapter 1. Fundamental processes of hydrogen negative ion production in the ion source plasma volume -- Chapter 2. Fundamental aspect of surface production of hydrogen negative ions -- Chapter 3. Modelling of reaction dynamics in volume production negative hydrogen ion sources -- Chapter 4. Particle-In-Cell Modelling of Negative Ion Sources for fusion applications -- Chapter 5. Particle-In-Cell Modelling with Monte-Carlo Collision of Extraction and Acceleration in Radio-Frequency Negative Ion Sources -- Chapter 6. Plasma neutralisation of 500 keV H- ions -- Chapter 7. Advanced models for negative ion production in hydrogen discharges -- Chapter 8. The plasma sheath in negative ion sources -- Chapter 9. Helicon volume production of H− and D− using a resonant birdcage antenna on RAID -- Chapter 10. Plasma electrode for Caesium free negative hydrogen ion sources -- Chapter 11. Low temperature high density ion source plasma -- Chapter 12. Fundamental principles of ECR-driven negative ion sources operating with hydrogen and deuterium -- Chapter 13. Dissociative electron attachment to hydrogen and its use for vibrational spectroscopy of hydrogen molecule -- Chapter 14. Physics of surface-plasma H- ion sources -- Chapter 15. Hydrogen negative ion density diagnostic in plasma -- Chapter 16. RF Driven ion sources for Fusion NBI -- Chapter 17. Negative ion source technique and technology -- Chapter 18. Radiofrequency driven, Pulsed High-current H- Ion Sources on Advanced Accelerators -- Chapter 19. Development of High Current Negative-Ion based Beam Source at QST for JT-60U and ITER Neutral Beam Injectors. |
Record Nr. | UNINA-9910726292103321 |
Cham : , : Springer International Publishing : , : Imprint : Springer, , 2023 | ||
Materiale a stampa | ||
Lo trovi qui: Univ. Federico II | ||
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Proceedings of the 8th International Conference on Attosecond Science and Technology / / edited by Luca Argenti, Michael Chini, Li Fang |
Edizione | [1st ed. 2024.] |
Pubbl/distr/stampa | Cham : , : Springer International Publishing : , : Imprint : Springer, , 2024 |
Descrizione fisica | 1 online resource (XIX, 220 p. 69 illus., 66 illus. in color.) |
Disciplina | 539 |
Soggetto topico |
Atomic structure
Molecular structure Physical chemistry Telecommunication Lasers Spectrum analysis Atomic and Molecular Structure and Properties Physical Chemistry Microwaves, RF Engineering and Optical Communications Laser Spectroscopy |
ISBN | 3-031-47938-6 |
Formato | Materiale a stampa |
Livello bibliografico | Monografia |
Lingua di pubblicazione | eng |
Nota di contenuto | Chapter 1. Single-cycle infrared waveform generation and control -- Chapter 2. Increase in Photon Flux of Attosecond Pulses -- Chapter 3. Bright coherent XUV generation in microfluidic glass devices for ultrafast x-ray spectroscopy -- Chapter 4. Attosecond Physics and Quantum Information Science -- Chapter 5. Dynamics via Attosecond Four-Wave Mixing -- Chapter 6. Optical control of autoionizing states in argon -- Chapter 7. Retrieving a Complex Molecular Structure from Laser-Induced Electron Diffraction using Ma-chine Learning -- Chapter 8. Imaging ultrafast Dissociation Dynamics: OCS & Roaming in Formaldehyde -- Chapter 9. Controlling the time evolution of electron-nuclei entanglement for steering vibronic coherences dynamics induced by short 1-2 fs optical pulses -- Chapter 10. An MQDT model for the description of time resolved pump probe experiments -- Chapter 11. ASTRA, A Transition Density Matrix Approach to the Interaction of Attosecond Radiation with Atoms and Molecules -- Chapter 12. Symmetry-protected chiral sensitivity in photoionization with bichromatic fields -- Chapter 13. Experimental investigation of topological property of degenereate singularities in rescattering processes -- Chapter 14. Simulating strong field tunnel ionization of molecules -- Chapter 15. Control of photoelectron-ion entanglement in attosecond laser-induced photoionization of H2 -- Chapter 16. Ultrafast Second-harmonic XUV Spectroscopy: A Novel Probe for Symmetry -- Chapter 17. From Ultrafast Light-Induced Currents to Spatially-Resolved Field Sampling -- Chapter 18. Attosecond core-exciton dynamics in wide-gap insulators -- Chapter 19. Polarization-Shaped Strong Field Control over Valley Polarization with Mid-IR Light -- Chapter 20. The Future of Attosecond Science. |
Record Nr. | UNINA-9910842097703321 |
Cham : , : Springer International Publishing : , : Imprint : Springer, , 2024 | ||
Materiale a stampa | ||
Lo trovi qui: Univ. Federico II | ||
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