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  • 1
    Online Resource
    Online Resource
    La Vergne :Royal Society of Chemistry, The,
    Keywords: Electronic books.
    Description / Table of Contents: This book discusses the present and the future perspectives of NMR techniques for environmental evaluations.
    Type of Medium: Online Resource
    Pages: 1 online resource (558 pages)
    Edition: 1st ed.
    ISBN: 9781837671250
    Series Statement: Issn Series
    DDC: 577.14
    Language: English
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  • 2
    Keywords: Electronic books.
    Description / Table of Contents: This book discusses the present and the future perspectives of NMR techniques for environmental evaluations.
    Type of Medium: Online Resource
    Pages: 1 online resource (558 pages)
    Edition: 1st ed.
    ISBN: 9781837671250
    Series Statement: ISSN
    Language: English
    Note: Cover -- Copyright -- Preface -- Contents -- Chapter 1 The Meaning of Pollution and the Powerfulness of NMR Techniques -- 1.1 Introduction: Pollution and Its Multifaceted Aspects -- 1.2 Modern NMR in the Context of Environmental Analysis and Remediation -- 1.3 Future Perspectives -- References -- Chapter 2 The Importance of NMR as a Discovery Tool -- 2.1 Introduction -- 2.2 Environmental Discovery -- 2.2.1 Water -- 2.2.2 Soil -- 2.2.3 Atmospheric -- 2.2.4 Partitioning -- 2.2.5 Others -- 2.3 Transformation Products -- 2.3.1 Environmental -- 2.3.1.1 Soil -- 2.3.1.2 Water -- 2.3.1.3 Atmospheric -- 2.3.1.4 Wastewater Treatment -- 2.3.1.5 Miscellaneous -- 2.3.2 Reaction Monitoring -- 2.4 Nontargeted Environmental Metabolomics -- 2.4.1 Aquatic Organisms -- 2.4.2 Terrestrial Vegetation -- 2.5 Food Science -- 2.5.1 Food Safety -- 2.5.2 Food Authentication -- 2.5.3 Other Applications -- 2.6 Heteronuclear NMR -- 2.6.1 Fluorine (19F) -- 2.6.2 Phosphorus (31P) -- 2.6.3 Nitrogen (15N) -- 2.6.4 Vanadium (51V) -- 2.6.5 Other Metals -- 2.7 Conclusion -- 2.7.1 Potential of Low-field and Portable NMR as a Discovery Tool -- 2.7.2 Hyphenated NMR -- Acknowledgments -- References -- Chapter 3 Sensitivity Enhancement in Environmental NMR: Current Technologies and Future Potential -- 3.1 Introduction -- 3.1.1 The Origin of an NMR Signal -- 3.2 Hyperpolarization Experiments -- 3.2.1 Dynamic Nuclear Polarization (DNP) -- 3.2.1.1 DNP in Solution: Overhauser DNP -- 3.2.1.2 Magic Angle Spinning (MAS-DNP): Hyperpolarization of Solids -- 3.2.1.3 Single Shot: Chemically and Dissolution Induced Hyperpolarization -- 3.2.1.4 Triplet DNP: Beyond the Boltzmann Distribution -- 3.2.2 Signal Amplification by Reversible Exchange (SABRE) -- 3.2.3 Chemically Induced DNP (CIDNP) -- 3.3 Hardware -- 3.3.1 Anatomy of an NMR Spectrometer -- 3.3.2 Field Strength, Pulsed Field, and Apparatus. , 3.3.3 Microcoils and RF Lenses -- 3.3.4 Detection: Multiplexing, Arrays and Cryogenic Cooling -- 3.4 Pulse Sequences, Processing, and Mathematics -- 3.4.1 Saving Time: Supersequences, Non-uniform Sampling, and Ultrafast Acquisition -- 3.4.2 Pulse Sequences: Indirect Measurements -- 3.4.3 Mathematical Approaches: Addressing the Root Cause -- Acknowledgments -- References -- Chapter 4 Comprehensive Multiphase NMR: Natural Samples in Their Natural State -- 4.1 Introduction -- 4.2 Spectral Editing Techniques -- 4.2.1 Isolating the Solution Fraction -- 4.2.2 Isolating the Gel Fraction (Restricted Diffusion) -- 4.2.3 Isolating the Semi-solid (Rigid Gel) Fraction -- 4.2.4 Isolating the Solid Components -- 4.2.5 Relaxation Based Spectral Editing -- 4.3 Multiphase Analysis of Molecular Structure in Natural Samples -- 4.3.1 Elucidating the Complex Structure of Soil Organic Matter and Oil Contaminated Soils -- 4.3.2 CMP-NMR to Study 13C Enriched Seeds and Germination Process -- 4.3.3 Applications of CMP-NMR to Monitor Structural Changes During Cooking -- 4.3.4 Extraction of Biofuel from Algae -- 4.3.5 Degradation of Car Engine Rubber by Biofuel -- 4.4 Multiphase Analysis of Molecular Interactions and Processes -- 4.4.1 Biomass and Clay Interactions -- 4.4.2 CMP-NMR to Monitor Perfluorinated Pollutant Sequestration in Soil -- 4.4.3 CMP-NMR to Monitor Photocatalytic Reactions -- 4.5 CMP-NMR as a Tool to Observe Metabolic Profiles of Intact Natural Samples -- 4.5.1 Ex Vivo CMP-NMR as a Complementary Tool to Understand In Vivo Processes -- 4.5.2 In Vivo CMP-NMR -- 4.5.3 Considerations and In Vivo CMP-NMR Progress -- 4.5.3.1 Slow Spinning Techniques to Reduce Stress -- 4.5.3.2 Ultraslow Spinning -- 4.5.3.3 Other Techniques to Attenuate Spinning Artifacts Arising from Slow Spinning -- 4.5.3.4 Water Suppression -- 4.5.3.5 Lipid Suppression. , 4.5.3.6 Sample Heating During Solid-state NMR -- 4.5.4 Multidimensional Metabolomics -- 4.5.4.1 2D NMR for Metabolomic Assignments -- 4.5.4.2 Slow Spinning Multidimensional NMR -- 4.6 Conclusions and Future Directions -- 4.6.1 Improving 13C Sensitivity -- 4.6.2 Larger Diameter Probes to Increase Biomass -- 4.6.3 Cryogenically Cooled Hardware -- 4.6.4 Micro-coils -- Acknowledgments -- References -- Chapter 5 Environmental In Vivo NMR: Explaining Toxicity and Processes at the Biochemical Level -- 5.1 Introduction -- 5.2 Pollution, Toxicity and the Environment -- 5.3 Types of In Vivo NMR -- 5.3.1 Solution State NMR -- 5.3.2 Magic Angle Spinning (MAS) NMR -- 5.4 In Vivo NMR - Challenges and Approaches -- 5.4.1 Broad Lineshape -- 5.4.2 Spectral Overlap -- 5.4.3 Water Suppression -- 5.4.4 Sensitivity -- 5.4.5 MAS Techniques - Organism Survival -- 5.4.6 MAS Techniques - Spinning Sidebands -- 5.5 In Vivo NMR Techniques: Applications and Examples -- 5.5.1 One-dimensional NMR -- 5.5.1.1 1H NMR -- 5.5.1.2 13C NMR -- 5.5.1.3 14N/15N NMR -- 5.5.1.4 31P NMR -- 5.5.1.5 Other Nuclei -- 5.5.2 Multidimensional Experiments -- 5.5.2.1 Correlation Spectroscopy (COSY) -- 5.5.2.2 Total Correlation Spectroscopy (TOCSY) -- 5.5.2.3 Heteronuclear Single Quantum Coherence (HSQC) and Heteronuclear Multiple Quantum Coherence (HMQC) -- 5.5.2.4 Heteronuclear Correlation (HETCOR) -- 5.5.2.5 Higher Dimensional Techniques -- 5.5.3 Selective Experiments -- 5.5.4 CMP NMR - Spectral Editing -- 5.5.5 Studying Interactions -- 5.6 Conclusion -- Acknowledgments -- References -- Chapter 6 Self-diffusion NMR as a Powerful Tool for the Evaluation of Environmental Contamination -- 6.1 Fundamentals of Diffusion Processes -- 6.2 Basics of Diffusion NMR -- 6.2.1 Fundamentals of Pulsed Field Gradient NMR -- 6.2.2 Pulse Sequences -- 6.2.3 Multi-phase Systems -- 6.2.4 Confined Diffusion -- References. , Chapter 7 Monitoring of Lubricating Oil Degradation Via Fast Field Cycling NMR Relaxometry -- 7.1 Introduction -- 7.2 A Brief History of FFC-NMR Relaxometry in Lubricants -- 7.3 Thermal Degradation of Paraffins -- 7.3.1 Paraffin Heat-induced Chemical Transformation -- 7.3.2 Theoretical Model -- 7.4 Thermal Degradation in ICE Lubricants -- 7.4.1 Thermal Stress in Oil Bases -- 7.4.2 Aging of Automotive Lubricating Oils -- 7.5 Concluding Remarks and Future Prospects -- References -- Chapter 8 MRI of Soil and Soil-Root Processes -- 8.1 Introduction -- 8.2 Nuclear Magnetic Resonance -- 8.2.1 Relaxation -- 8.2.2 Imaging -- 8.2.3 Image Contrast -- 8.2.4 MRI, X-ray CT and Neutron CT -- 8.3 Bare Soil -- 8.4 Roots and Root-Soil Interactions -- 8.4.1 Root System Architecture Imaging -- 8.4.2 Root-Soil Interactions -- 8.4.3 MRI Solute: Na -- 8.4.4 MRI Solute: Paramagnetic Tracers -- 8.5 Concluding Remarks -- Acknowledgments -- References -- Chapter 9 Using Magnetic Resonance Imaging to Study Contaminant Dynamics -- 9.1 Why Use MRI for Soil Contaminant Study -- 9.2 Structural MRI of Soils and Soil-like Systems -- 9.2.1 Initial Studies -- 9.2.2 Evolution of the Technique and Physical Limitations -- 9.2.3 Application to Contaminant Dynamics -- 9.2.4 Discrimination of Fluid Phases -- 9.2.4.1 Intrinsic Properties -- 9.2.5 Heteronuclear MRI -- 9.2.5.1 Manipulating Relaxation Times -- 9.2.5.1.1 Spin-Spin Relaxation Time -- 9.3 Applications of MRI to Understand Physical Processes -- 9.4 MRI of Flow Through Soils -- 9.4.1 Generalised Fluid Flow Used to Predict Contaminant Behaviour -- 9.4.2 Flow of Contaminant-like Fluids -- 9.5 Reactive Contaminants and Their Kinetics -- 9.6 Imaging of Biofilms in Soils -- 9.7 Earth's Field Magnetic Resonance -- 9.8 Conclusions and Future Directions -- 9.9 A Starting Point for Experiments -- References. , Chapter 10 NMR Relaxation in Porous Media for Environmental Applications -- 10.1 Introduction -- 10.2 Theory of NMR Relaxation in Porous Media -- 10.3 Applications -- 10.3.1 Soil -- 10.3.2 Contaminants -- 10.3.3 Biofilms -- 10.3.4 Carbon Storage -- 10.3.5 Hydrates -- 10.3.6 Marine Life -- 10.4 Conclusions -- References -- Chapter 11 Characterization of Cyclodextrin Cross-linked Polymers Used in Environmental Applications by Solid-state NMR Spectroscopy: a Historical Review -- 11.1 Introduction -- 11.2 β-Cyclodextrin Cross-linked Polymers for Wastewater Treatment -- 11.2.1 Synthesis of Cross-linked Polymers Prepared by Direct Cross-linking of β-Cyclodextrin -- 11.2.2 Chemical Functionalization of β-Cyclodextrin Cross-linked Polymers -- 11.2.3 A Brief and Recent Review of the Literature on the Use of β-Cyclodextrin Cross-linked Polymers as Biosorbents -- 11.3 History of NMR Structure Determination of β-Cyclodextrin Cross-linked Polymers -- 11.4 NMR Characterization of β-Cyclodextrin Cross-linked Polymers -- 11.5 Usefulness of NMR Techniques to Characterize the Biosorption Mechanism -- 11.6 Conclusion -- Abbreviations -- Acknowledgments -- References -- Chapter 12 NMR Techniques for the Evaluation of Biochar Characteristics -- 12.1 What Biochar Is: A Definition -- 12.2 Biochar Environmental Relevance -- 12.3 Chemical-Physical Biochar Characteristics -- 12.4 Biochar and Nuclear Magnetic Resonance Techniques: High-resolution Spectroscopy -- 12.5 Biochar Characteristics Via 2D Hetero-correlated Solid-state Spectroscopy -- 12.6 Other Physical Limitations in the Application of High-resolution Spectroscopy for Biochar Analyses -- 12.7 Low-resolution NMR -- 12.8 The Basics of the NMR Relaxation -- 12.9 T2 Monitoring for Biochar Characterization -- 12.10 Application of FFC NMR Relaxometry to Unveil Biochar Properties -- 12.11 Conclusions and Perspectives. , References.
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  • 3
    Publication Date: 2021-04-14
    Description: In February 2016, 47 ingots were found in the seabed of Contrada Bulala (Gela, CL, Italy) near the site where 40 ingots had previously been recovered. The ingots composition was determined to be a Cu - Zn alloy, dated by the archaeologist to the VI century B.C. This specific alloy was then known as Orichalcum. From an archaeological point of view, the first question raised about the new discovery was whether the ingots of the first and the second excavations belonged to the same shipwreck. Following the previous study, an elemental analysis was performed on the ingots from the second finding by using ICP-OS and ICP-MS techniques. The chemometric treatment of the analytical results obtained on both sets, i.e. ingots from first and second discovery, confirms their similarity. Therefore, the two findings can be considered to belong to the same naval load. The lead isotopic ratios were determined on selected/representative ingots to improve the knowledge about this treasure. Results can provide information about probable location of the lead sources, that could be very useful for the reconstruction of the ancient trade routes in the Mediterranean Sea.
    Description: Published
    Description: 102901
    Description: 2IT. Laboratori analitici e sperimentali
    Description: JCR Journal
    Keywords: Orichalcum ingots ; Lead Isotopic ratio ; ICP-OES ICP-MS ; Chemometric approach ; 05.09. Miscellaneous
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
    Type: article
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  • 4
    Publication Date: 2017-09-13
    Description: In this work a careful ICP-OES and ICP-MS investigation of 38 ancient ingots has been performed to determine both major components and trace elements content to find a correlation between the observed different features and the composition. The ingots, recovered in an underwater archaeological site of various finds near Gela (CL, Italy), were previously investigated by X-Ray Fluorescence (XRF) spectroscopy to know the composition of the alloy and it was found that the major elements were copper and zinc, in a ratio compatible with the famous orichalcum similar to the contemporary brass that was considered a precious metal in ancient times. The discovery of huge amount this alloy is extraordinary. Following a chemometric approach at first, the use of Principal Component Analysis (PCA) and Cluster Analysis (CA) allowed us to highlight three well-defined groups of ingots and to point out three ingots that appeared outlier with respect to the whole sample set. Linear Discriminant Analysis (LDA) and Soft Independent Modeling of Class Analogy (SIMCA) enabled us to confirm the difference between the hypothesized groups. The prediction power of the variables computed by SIMCA allowed us pointing out some elements able to differentiate each group. The three well-defined groups of ingots resulting from the chemometric analysis were in agreement with the observations of some morphological parameters such as ingot shape, width, and length and weight and by the presence of different kind of patina. The appearance of three distinctive families of ingots can indicate different geographical location of the furnace, different technology stages and/or different raw material used in melting process and the morphology is indicative of cast diverse technologies. These findings can signify the starting point for giving important insights in the archaeometric study of the orichalcum ingots regarding the provenience and the manufacture technologies.
    Description: Published
    Description: 163–170
    Description: 2IT. Laboratori sperimentali e analitici
    Description: JCR Journal
    Keywords: Orichalcum ingots; ICP-OES; ICP-MS; Chemometric approach ; 05.04. Instrumentation and techniques of general interest
    Repository Name: Istituto Nazionale di Geofisica e Vulcanologia (INGV)
    Type: article
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