Sökning: "Reaction mechanism"

Visar resultat 16 - 20 av 698 avhandlingar innehållade orden Reaction mechanism.

  1. 16. Ultrafast Photo-induced Reaction Dynamics of Small Molecules

    Författare :Malin Kadi; Jan Davidsson; Eva Åkesson; Sören Keiding; Uppsala universitet; []
    Nyckelord :NATURVETENSKAP; NATURAL SCIENCES; Physical chemistry; pump-probe spectroscopy; reaction dynamics; photodissociation; aryl halides; spin-orbit coupling; ab initio calculations; molecular dynamics; vibrational wavepackets; Fysikalisk kemi; Physical chemistry; Fysikalisk kemi;

    Sammanfattning : The main focus of this thesis is the investigation of the dissociation dynamics of aryl halides using femtosecond pump-probe spectroscopy. In the monohalogenated aryl halides, iodo-, bromo- and chlorobenzene, the rate of dissociation following excitation at 266 nm in the gas phase increased with increasing mass of the halogen atom. LÄS MER

  3. 17. On the mechanism of electrophilic aromatic substitution : an investigation by means of the effect of isotopic mass on reaction velocity

    Författare :Lars Melander; Stockholms högskola; []
    Nyckelord :;

    Sammanfattning : .... LÄS MER

  4. 18. Organic Synthesis in Nonionic Microemulsions

    Författare :Maria Häger; Chalmers tekniska högskola; []
    Nyckelord :NATURVETENSKAP; NATURAL SCIENCES; organic reaction; phase behaviour; microemulsion; reaction kinetics;

    Sammanfattning : The aim of this work has been to explore the use of microemulsions as reaction media for organic synthesis. Another important aim has been to improve the understanding of the reaction kinetics and the mechanism of the reaction in this type of surfactant system. LÄS MER

  5. 19. Homogeneous Ignition - Chemical Kinetic Studies for IC-Engine Applications

    Författare :Per Amnéus; Förbränningsfysik; []
    Nyckelord :NATURVETENSKAP; NATURAL SCIENCES; Skeletal mechanism; Mechanism reduction; n-heptane; iso-octane; formaldehyde; methane; Motors and propulsion systems; Motorer; framdrivningssystem; Physics; Fysik; Detailed chemistry; Kinetic calculations; Engine knock; Homogeneous charge compression ignition; HCCI; Fysicumarkivet A:2002:Amnéus;

    Sammanfattning : Calculations on a Homogeneous Charge Compression Ignition (HCCI) engine have been performed. Zero-dimensional models were used. The simplest model compressed the gas to auto-ignition, using temperature and pressure at a certain crank angle position obtained from engine experiments. LÄS MER

  7. 20. Quantum Chemical Modeling of Enzymatic Methyl Transfer Reactions

    Författare :Polina Georgieva; Fahmi Himo; Nino Russo; KTH; []
    Nyckelord :NATURVETENSKAP; NATURAL SCIENCES; reaction mechanism; Theoretical chemistry; Teoretisk kemi;

    Sammanfattning : In this thesis, quantum chemistry, in particular the B3LYP density functional method, is used to investigate a number of methyl transfer enzymes. Quantum chemical methodology is today a very important tool in the elucidation of properties and reaction mechanisms of enzyme active sites. LÄS MER