Sökning: "Reaction rate constants"

Visar resultat 1 - 5 av 58 avhandlingar innehållade orden Reaction rate constants.

  1. 1. Process modeling of semibatch reaction crystallization

    Författare :Marie Ståhl; Åke Rasmuson; Hermann J.M. Kramer; KTH; []
    Nyckelord :NATURVETENSKAP; NATURAL SCIENCES; Reaction crystallization; benzoic acid; nucleation; growth; kinetics; growth rate dispersion; Chemical physics; Kemisk fysik;

    Sammanfattning : This thesis aims at increasing the fundamental understanding of reaction crystallization by modeling, simulations and parameter estimation. Benzoic acid is used as the model compound. LÄS MER

  3. 2. Chemometric methods for analysis of spectroscopic data from batch process monitoring

    Författare :Erik Furusjö; KTH; []
    Nyckelord :in situ spectroscopy; reaction monitoring; organic synthesis; solubility; crystallization; multivariate calibration; curve resolution; kinetic model; reaction rate constant; activation energy; target testing; bootstrap;

    Sammanfattning : Understanding of a process is essential for processdevelopment, optimisation and scale-up. In situ spectroscopy isan attractive measurement technique that can increase processunderstanding, since samples need not be retrieved from theprocess mixture. LÄS MER

  4. 3. Quantum dynamical effects in complex chemical systems

    Författare :S. Karl-Mikael Svensson; Göteborgs universitet; []
    Nyckelord :NATURVETENSKAP; NATURAL SCIENCES; NATURVETENSKAP; NATURAL SCIENCES; NATURVETENSKAP; NATURAL SCIENCES; Quantum dynamics; Radiative association; Classical Wigner method; Feynman path integral; Reaction rate constants; Wigner phase space;

    Sammanfattning : When using mathematical models to computationally investigate a chemical system it is important that the methods used are accurate enough to account for the relevant properties of the system and at the same time simple enough to be computationally affordable. This thesis presents research that so far has resulted in three published papers and one unpublished manuscript. LÄS MER

  5. 4. Formation of small molecules in space through the process of radiative association

    Författare :Daria Jones; Göteborgs universitet; []
    Nyckelord :NATURVETENSKAP; NATURAL SCIENCES; astrochemistry; reaction rate constants; formation of molecules; physical chemistry;

    Sammanfattning : This thesis is dedicated to calculating the reaction rate constants for the formation of molecules through radiative association (RA) under interstellar conditions. The molecules that have been studied are CH, AlCl, Na+ − H2 and Al+ − H2. LÄS MER

  7. 5. Radiation Induced Oxidative Dissolution of UO2

    Författare :Ella Ekeroth; Mats Jonsson; Bernd Grambow; KTH; []
    Nyckelord :NATURVETENSKAP; NATURAL SCIENCES; radiation; radiolysis; UO2; spent nuclear fuel; radicals; oxidants; reductants; rate constants; dissolution; H2O2; H2; Nuclear chemistry; Kärnkemi;

    Sammanfattning : Sammanfattning Denna doktorsavhandling berör oxidativ upplösning av UO2 (som modellsubstans för utbränt kärnbränsle) orsakad av radiolys av vatten samt effekten av H2 på denna denna process. Hastighetskonstanter för oxidation av UO2-pulver med olika oxidanter såsom H2O2 har bestämts experimentellt. LÄS MER