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Ab Initio Molecular Dynamics Analysis Based on Reduced-Dimensionality Reaction Route Map / / by Takuro Tsutsumi
Ab Initio Molecular Dynamics Analysis Based on Reduced-Dimensionality Reaction Route Map / / by Takuro Tsutsumi
Autore Tsutsumi Takuro
Edizione [1st ed. 2023.]
Pubbl/distr/stampa Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2023
Descrizione fisica 1 online resource (123 pages)
Disciplina 541.394
Collana Springer Theses, Recognizing Outstanding Ph.D. Research
Soggetto topico Reaction mechanisms (Chemistry)
Chemistry, Physical and theoretical
Quantum theory
Materials science - Data processing
Electronic structure
Quantum chemistry - Computer programs
Reaction Mechanisms
Theoretical Chemistry
Excited States
Electronic Structure Calculations
ISBN 981-9973-21-X
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto General Introduction -- Analysis of On-the-fly Trajectory based on Reaction Route Network -- 3. Visualization of Unique Reaction Route Map by Dimensionality Reduction Method -- 4. Projection of Dynamical Reaction Route onto Reduced-dimensionality Reaction Space -- 5. Theoretical Study of Excited-state Branching Reaction Mechanisms of α-methyl-cis-stilbene -- 6. Visualization of Multi-state Potential Energy Landscape: A Case Study on Excited-state Branching Reaction of Stilbene -- 7. General Conclusion. .
Record Nr. UNINA-9910760297503321
Tsutsumi Takuro  
Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2023
Materiale a stampa
Lo trovi qui: Univ. Federico II
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Advances in Organic Crystal Chemistry : Comprehensive Reviews 2025 on Crystal Functions / / edited by Seiya Kobatake, Hidehiro Uekusa
Advances in Organic Crystal Chemistry : Comprehensive Reviews 2025 on Crystal Functions / / edited by Seiya Kobatake, Hidehiro Uekusa
Autore Kobatake Seiya
Edizione [1st ed. 2025.]
Pubbl/distr/stampa Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2025
Descrizione fisica 1 online resource (279 pages)
Disciplina 548
Altri autori (Persone) UekusaHidehiro
Soggetto topico Crystallography
Reaction mechanisms (Chemistry)
Photonic crystals
Liquid crystals
Nonmetallic materials
Crystallography and Scattering Methods
Reaction Mechanisms
Photonic Crystals
Liquid Crystals
Organic Molecules in Materials Science
ISBN 981-9644-79-8
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto Alternating Copolymerizations via Alternating 1D Columnar Molecular Assemblies of p-Quinodimethane Derivatives in Solution and Solid States -- Cooperative Photochemical Reactions in Organic Molecular Crystals -- Versatile and Fast Organic Crystal Actuation by Photothermal Effect and Natural Vibration -- Photoresponsive Crystals with Bio-Mimetic Functions -- Mechanical Properties in Organic Molecular Crystals Toward Photonic Applications -- Tunable Mechanochromic Luminescence of Organic Crystals -- Development of Organic Semiconductors with Exceptional Layered Crystallinity -- Control of Molecular Orientation in Asymmetric Thienoacene-Based Organic Semiconductors -- Polarization-Induced Phenomena in Ferroelectric Liquid Crystals Comprising of Extended π-Conjugated Units -- Magneto-Structural Correlation in Organic Radical Crystals Containing Nitroxyl and Triazinyl Spin Centers -- Construction of Molecule-based Strongly Isotropic Lattices and their Physical Properties.
Record Nr. UNINA-9911016071503321
Kobatake Seiya  
Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2025
Materiale a stampa
Lo trovi qui: Univ. Federico II
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Alicyclic Chemistry / / by V.K. Ahluwalia, Renu Aggarwal
Alicyclic Chemistry / / by V.K. Ahluwalia, Renu Aggarwal
Autore Ahluwalia V.K
Edizione [2nd ed. 2023.]
Pubbl/distr/stampa Cham : , : Springer Nature Switzerland : , : Imprint : Springer, , 2023
Descrizione fisica 1 online resource (XIII, 222 p. 482 illus.)
Disciplina 541.39
Soggetto topico Reaction mechanisms (Chemistry)
Chemical structure
Chemistry, Organic
Reaction Mechanisms
Structure And Bonding
Organic Chemistry
ISBN 3-031-36068-0
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto Introduction -- Nomenclature of Cycloalkanes -- Synthesis of Cycloalkanes -- Properties of Cycloalkanes -- Chemistry of Small Rings -- Chemistry of Common Ring Compounds -- Chemistry of Medium Sized and Larger Rings -- Conformations of Cycloalkanes -- Cycloalkanes Containing an Heteroatom (Heterocyclic Compounds) -- Non-Benzenoid Aromatics -- Bridged Rings -- The Cage Molecules -- Tropones and Tropolones -- Fluxional Molecules -- Catenanes, Rotaxanes and Knots.
Record Nr. UNINA-9910734895103321
Ahluwalia V.K  
Cham : , : Springer Nature Switzerland : , : Imprint : Springer, , 2023
Materiale a stampa
Lo trovi qui: Univ. Federico II
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Biophysical Chemistry : Techniques and Applications / / by C. Kalidas, M.V. Sangaranarayanan
Biophysical Chemistry : Techniques and Applications / / by C. Kalidas, M.V. Sangaranarayanan
Autore Kalidas C
Edizione [1st ed. 2023.]
Pubbl/distr/stampa Cham : , : Springer Nature Switzerland : , : Imprint : Springer, , 2023
Descrizione fisica 1 online resource (491 pages)
Disciplina 572.43
Altri autori (Persone) SangaranarayananM. V
Soggetto topico Biomaterials
Bioorganic chemistry
Reaction mechanisms (Chemistry)
Bioorganic Chemistry
Reaction Mechanisms
ISBN 3-031-37682-X
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto Cell and its Biochemical Setup -- Thermodynamic Aspects of the Cell -- Carbohydrates, their Reactions, Thermochemistry and Energetics -- Lipids -- Amino Acids -- Peptides -- Proteins -- Nucleosides and Nucleotides -- Enzymes -- Co-Enzymes and Vitamins -- Bioenergetics -- Biosensors.
Record Nr. UNINA-9910734878003321
Kalidas C  
Cham : , : Springer Nature Switzerland : , : Imprint : Springer, , 2023
Materiale a stampa
Lo trovi qui: Univ. Federico II
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The Chemical Reactor from Laboratory to Industrial Plant : A Modern Approach to Chemical Reaction Engineering / / by Riccardo Tesser, Elio Santacesaria
The Chemical Reactor from Laboratory to Industrial Plant : A Modern Approach to Chemical Reaction Engineering / / by Riccardo Tesser, Elio Santacesaria
Autore Tesser Riccardo
Edizione [2nd ed. 2025.]
Pubbl/distr/stampa Cham : , : Springer Nature Switzerland : , : Imprint : Springer, , 2025
Descrizione fisica 1 online resource (XXIII, 725 p. 506 illus., 208 illus. in color.)
Disciplina 660
Soggetto topico Chemistry, Technical
Thermodynamics
Heat engineering
Heat - Transmission
Mass transfer
Chemistry, Physical and theoretical
Reaction mechanisms (Chemistry)
Chemical engineering
Biotechnology
Industrial Chemistry
Engineering Thermodynamics, Heat and Mass Transfer
Physical Chemistry
Reaction Mechanisms
Chemical Process Engineering
Chemical Bioengineering
ISBN 3-031-82502-0
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto Chapter 1 Introduction to the Study of Chemical Industrial Processes -- Chapter 2 Thermodynamics of Physical and Chemical Transformations -- Chapter 3 The Role of Catalysis in Promoting Chemical Reactions -- Chapter 4 Kinetics of Homogeneous Reactions and Related Mechanisms -- Chapter 5 Kinetics of Heterogeneous Reactions and Related Mechanisms -- Chapter 6 Kinetics of and Transport Phenomena in Gas–Solid Reactors -- Chapter 7 Kinetics and Transport Phenomena in Multi-phase Reactors -- Chapter 8 Polymerization Reactions and Reactors -- Chapter 9 Bioreactors.
Record Nr. UNINA-9911001782903321
Tesser Riccardo  
Cham : , : Springer Nature Switzerland : , : Imprint : Springer, , 2025
Materiale a stampa
Lo trovi qui: Univ. Federico II
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Click Chemistry / / by Vinod K. Tiwari, Manoj K. Jaiswal, Sanchayita Rajkhowa, Sumit K. Singh
Click Chemistry / / by Vinod K. Tiwari, Manoj K. Jaiswal, Sanchayita Rajkhowa, Sumit K. Singh
Autore Tiwari Vinod K.
Edizione [1st ed. 2024.]
Pubbl/distr/stampa Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2024
Descrizione fisica 1 online resource (684 pages)
Disciplina 541.395
Collana Materials Horizons: From Nature to Nanomaterials
Soggetto topico Reaction mechanisms (Chemistry)
Organometallic chemistry
Bioorganic chemistry
Reaction Mechanisms
Organometallic Chemistry
Bioorganic Chemistry
ISBN 9789819745968
9789819745951
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto Click Chemistry and Bioorthogonal Chemistry: General Consideration from Discovery to Applications -- CuAAC ‘Click Chemistry’ Mediated Synthesis of 1,4-Disubstituted 1,2,3-Triazoles -- RuAAC ‘Click Chemistry’ Mediated Synthesis of 1,5-Disubstituted 1,2,3-Triazole -- Organocatalyzed 1,2,3-Triazoles Forming Click Chemistry -- Catalyst-free 1,2,3-Triazole Forming Greener Approaches -- Bioothogonal Click Chemistry: Invention to Applications in Living Systems -- Thiol-Ene ‘Click Chemistry’: Discovery to Applications -- SuFEx Click Chemistry: Discovery to Applications -- CuAAC ‘Click Chemistry’ in Synthesis of Peptide and Protein Conjugates -- Click Chemistry in Dendrimer Synthesis -- Click Chemistry in Polymer Science -- Click Chemistry in Lipid Modification -- Click Chemistry in Glycoscience -- Click Chemistry in Nucleic Acid Chemistry -- Click Mediated 1,2,3-Triazoles in Drug Development.
Record Nr. UNINA-9910874687203321
Tiwari Vinod K.  
Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2024
Materiale a stampa
Lo trovi qui: Univ. Federico II
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Copper(I)-Catalyzed Stereoselective Borylation Reactions : Multisubstituted Alkenyl and Allylic Boronates / / by Yu Ozawa
Copper(I)-Catalyzed Stereoselective Borylation Reactions : Multisubstituted Alkenyl and Allylic Boronates / / by Yu Ozawa
Autore Ozawa Yu
Edizione [1st ed. 2023.]
Pubbl/distr/stampa Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2023
Descrizione fisica 1 online resource (236 pages)
Disciplina 546.652595
Collana Springer Theses, Recognizing Outstanding Ph.D. Research
Soggetto topico Organometallic chemistry
Chemistry
Catalysis
Reaction mechanisms (Chemistry)
Natural products
Pharmaceutical chemistry
Organometallic Chemistry
Chemical Synthesis
Reaction Mechanisms
Natural Products
Medicinal Chemistry
ISBN 9789819910984
9789819910977
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto 1. General Introduction -- 2. Modification of QuinoxP*-Type Bisphosphine Ligands for High-Performance Asymmetric Boryl Substitution of Racemic Allyl Electrophiles -- 3. Allylcopper(I) Isomerization-Enabled Copper(I)-Catalyzed Intramolecular Alkylboration of Terminal Allenes -- 4. Intermolecular Alkylboration of gem-Disubstituted Allenes for Stereoselective Synthesis of Multi-Alkylated Allylic Boronates -- 5. Computational Investigation on Copper(I)-Catalyzed Enantioselective Radical Borylation of Benzyl Halides -- 6. Summary of This Thesis.
Record Nr. UNINA-9910720074003321
Ozawa Yu  
Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2023
Materiale a stampa
Lo trovi qui: Univ. Federico II
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Deep Eutectic Solvents in the Textile Industry / / by Amjad Farooq, Hafeezullah Memon, Aamir Farooq, Zongqian Wang
Deep Eutectic Solvents in the Textile Industry / / by Amjad Farooq, Hafeezullah Memon, Aamir Farooq, Zongqian Wang
Autore Farooq Amjad
Edizione [1st ed. 2024.]
Pubbl/distr/stampa Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2024
Descrizione fisica 1 online resource (100 pages)
Disciplina 572.56682
Soggetto topico Nanochemistry
Reaction mechanisms (Chemistry)
Green chemistry
Building materials
Reaction Mechanisms
Green Chemistry
Wood, fabric, and textiles
ISBN 981-9764-33-5
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto Chapter 1 Introduction -- Chapter 2 Nanocellulose isolation techniques 20 -- Chapter 3 Characteristics of deep eutectic solvents.
Record Nr. UNINA-9910882890103321
Farooq Amjad  
Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2024
Materiale a stampa
Lo trovi qui: Univ. Federico II
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Design, Synthesis, and Properties of Redox-Active Bisquinodimethanes / / by Takashi Harimoto
Design, Synthesis, and Properties of Redox-Active Bisquinodimethanes / / by Takashi Harimoto
Autore Harimoto Takashi
Edizione [1st ed. 2025.]
Pubbl/distr/stampa Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2025
Descrizione fisica 1 online resource (146 pages)
Disciplina 547
Collana Springer Theses, Recognizing Outstanding Ph.D. Research
Soggetto topico Chemistry, Organic
Reaction mechanisms (Chemistry)
Chemistry
Electrochemistry
Electronics - Materials
Organic Chemistry
Reaction Mechanisms
Chemical Synthesis
Electronic Materials
ISBN 9789819615919
9819615917
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto 1. General Introduction -- 2. Enhancement of NIR-Absorbing Ability of Bis(diarylmethylium)-Type Dicationic Dyes Based on an Ortho-Substitution Strategy -- 3. Octaarylated Bisquinodimethanes: Double Dynamic Redox Systems Enabling the Control of [n]Acene Structure and NIR Absorptions -- 4. Domino-Redox Reaction Induced by a Conformational Change Based on Dithiin Bisquinodimethane Skeleton.
Record Nr. UNINA-9910983329903321
Harimoto Takashi  
Singapore : , : Springer Nature Singapore : , : Imprint : Springer, , 2025
Materiale a stampa
Lo trovi qui: Univ. Federico II
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Efficient Control and Spontaneous Transitions / / by Miranda Louwerse
Efficient Control and Spontaneous Transitions / / by Miranda Louwerse
Autore Louwerse Miranda
Edizione [1st ed. 2024.]
Pubbl/distr/stampa Cham : , : Springer Nature Switzerland : , : Imprint : Springer, , 2024
Descrizione fisica 1 online resource (123 pages)
Disciplina 547.2
Collana Springer Theses, Recognizing Outstanding Ph.D. Research
Soggetto topico Thermodynamics
Biophysics
Biomolecules
Biochemistry
Reaction mechanisms (Chemistry)
Coding theory
Information theory
Condensed matter
Molecular Biophysics
Reaction Mechanisms
Coding and Information Theory
Phase Transitions and Multiphase Systems
ISBN 3-031-40534-X
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto Chapter 1: Introduction -- Chapter 2: Theoretical Background -- Chapter 3: Information Thermodynamics of Transition Paths -- Chapter 4: Multidimensional Minimum-Work Protocols -- Chapter 5: Connections between Minimum-Work Protocols and Transition Paths -- Chapter 6 Conclusions.
Record Nr. UNINA-9910760268703321
Louwerse Miranda  
Cham : , : Springer Nature Switzerland : , : Imprint : Springer, , 2024
Materiale a stampa
Lo trovi qui: Univ. Federico II
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