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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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Alkali-silica reaction mechanisms and detection : an advanced understanding
Alkali-silica reaction mechanisms and detection : an advanced understanding
Pubbl/distr/stampa McLean, VA : , : U.S. Department of Transportation, Federal Highway Administration, Research, Development, and Technology, Turner-Fairbank Highway Research Center, , 2014
Descrizione fisica 1 online resource (12 pages) : color illustrations
Collana Techbrief
Soggetto topico Concrete - Deterioration
Reaction mechanisms (Chemistry)
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Altri titoli varianti Alkali-silica reaction mechanisms and detection
Record Nr. UNINA-9910703501903321
McLean, VA : , : U.S. Department of Transportation, Federal Highway Administration, Research, Development, and Technology, Turner-Fairbank Highway Research Center, , 2014
Materiale a stampa
Lo trovi qui: Univ. Federico II
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Arrow-pushing in organic chemistry : an easy approach to understanding reaction mechanisms / / Daniel E. Levy
Arrow-pushing in organic chemistry : an easy approach to understanding reaction mechanisms / / Daniel E. Levy
Autore Levy D. E (Daniel E.)
Edizione [Second edition.]
Pubbl/distr/stampa Hoboken, New Jersey : , : Wiley, , 2017
Descrizione fisica 1 online resource (600 pages)
Disciplina 547.2
Soggetto topico Chemistry, Organic
Reaction mechanisms (Chemistry)
ISBN 1-118-99120-6
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto Introduction -- Free radicals -- Acids -- Bases and nucleophiles -- SN2 substitution reactions -- SN1 substitution reactions -- Elimination reactions -- Addition reactions -- Carbenes -- Pericyclic reactions -- Moving forward.
Record Nr. UNINA-9910165038703321
Levy D. E (Daniel E.)  
Hoboken, New Jersey : , : Wiley, , 2017
Materiale a stampa
Lo trovi qui: Univ. Federico II
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Bioinorganic reaction mechanisms
Bioinorganic reaction mechanisms
Pubbl/distr/stampa Berlin : , : De Gruyter, , [2011-2013]
Disciplina 541.39
Soggetto topico Reaction mechanisms (Chemistry)
Bioinorganic chemistry
Chemical reactions
ISSN 2191-2491
Formato Materiale a stampa
Livello bibliografico Periodico
Lingua di pubblicazione eng
Record Nr. UNISA-996336297203316
Berlin : , : De Gruyter, , [2011-2013]
Materiale a stampa
Lo trovi qui: Univ. di Salerno
Opac: Controlla la disponibilità qui
Bioinorganic reaction mechanisms
Bioinorganic reaction mechanisms
Pubbl/distr/stampa Berlin : , : De Gruyter, , [2011-2013]
Disciplina 541.39
Soggetto topico Reaction mechanisms (Chemistry)
Bioinorganic chemistry
Chemical reactions
ISSN 2191-2491
Formato Materiale a stampa
Livello bibliografico Periodico
Lingua di pubblicazione eng
Record Nr. UNINA-9910140914703321
Berlin : , : De Gruyter, , [2011-2013]
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
Opac: Controlla la disponibilità qui
Chemical kinetic modeling and mass spectrometric and laser-induced fluorescence measurements of NH₃/N₂O flames [[electronic resource] /] / Demetris T. Venizelos, Rosario C. Sausa
Chemical kinetic modeling and mass spectrometric and laser-induced fluorescence measurements of NH₃/N₂O flames [[electronic resource] /] / Demetris T. Venizelos, Rosario C. Sausa
Autore Venizelos Demetris T
Pubbl/distr/stampa Aberdeen Proving Ground, MD : , : Army Research Laboratory, , [2002]
Descrizione fisica 1 online resource (x, 18 pages) : illustrations
Altri autori (Persone) SausaRosario C
Collana ARL-TR
Soggetto topico Reaction mechanisms (Chemistry)
Mass spectrometry
Laser spectroscopy
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Record Nr. UNINA-9910699997603321
Venizelos Demetris T  
Aberdeen Proving Ground, MD : , : Army Research Laboratory, , [2002]
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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