Researcher: Tabriz, Meisam Farzalipour
Name Variants
Tabriz, Meisam Farzalipour
Email Address
Birth Date
2 results
Search Results
Now showing 1 - 2 of 2
Publication Metadata only Energy landscapes in photochemical dissociation of small peroxides(Amer Chemical Soc, 2019) N/A; N/A; N/A; Department of Chemistry; Tabriz, Meisam Farzalipour; Çizmeciyan, Melisa Natali; Birer, Özgür; Yurtsever, İsmail Ersin; Master Student; PhD Student; Researcher; Faculty Member; Department of Chemistry; Koç University Surface Science and Technology Center (KUYTAM) / Koç Üniversitesi Yüzey Teknolojileri Araştırmaları Merkezi (KUYTAM); Graduate School of Sciences and Engineering; Graduate School of Sciences and Engineering; N/A; College of Sciences; N/A; N/A; N/A; 7129Organic peroxides are known to have important roles in many chemical and biochemical processes such as intermediates in the oxidation of various hydrocarbons, as initiators of free-radical polymerization and cross-linking agents, etc. Consequently, the study of the organic peroxides and their radicals are of fundamental interest and importance. Although several reaction pathways after dissociation of organic peroxides have been successfully identified using time-resolved optical absorption spectroscopy, interpretation of the data can be complicated due to spectral overlap of parent molecules, intermediates, and products. Therefore, a reliable theoretical framework is necessary in case of complex or less studied systems. In this study, we investigated the plausible thermal dissociation pathways of diethyl peroxide, ditert butyl peroxide, and dicumyl peroxide by density functional theory with M06-2X hybrid functional and compared its results to coupled cluster single double and perturbative triple, CCSD(T), level energies. Our results indicate that methyl radical elimination is the main dissociation mechanism for all of the studied peroxides after O-O bond cleavage which has been also observed in experiments. The resulting relative energies of the M06-2X functional were found to have reasonable accuracy in comparison with the CCSD(T) method. We also show that time-dependent density functional theory (TD-DFT) with the M06-2X functional provides a suitable guide for interpretation of time-resolved optical absorption spectra of peroxides. The experimental transient absorption spectra of dicumyl peroxide are interpreted using the theoretically predicted pathways and transient radical species. Both results agree within experimental resolution and accuracy. We propose that the traditionally assigned visible absorption is not due to the cumuloxyl radical and the photodissociation of dicumyl peroxide involves other pathways with extremely short-lived radicals.Publication Metadata only Effect of experimental factors on magnetic properties of nickel nanoparticles produced by chemical reduction method using a statistical design(Elsevier Science Sa, 2015) Vaezi, M. R.; Moradi, O. Mohammad; Barzgarvishlaghi, Mahsa; Tabriz, Meisam Farzalipour; PhD Student; Master Student; Graduate School of Sciences and Engineering; Graduate School of Sciences and Engineering; N/A; N/ANickel nanoparticles were synthesized by chemical reduction method in the absence of any surface capping agent. The effect of reactants mixing rate and the volume ratio of methanol/ethanol as solvent on the morphology and magnetic properties of nickel nanoparticles were studied by design of experiment using central composite design. X-ray diffraction (XRD) technique and Transmission Electron Microscopy (TEM) were utilized to characterize the synthesized nanoparticles. Size distribution of particles was studied by Dynamic Light Scattering (DLS) technique and magnetic properties of produced nanoparticles were investigated by Vibrating Sample Magnetometer (VSM) apparatus. The results showed that the magnetic properties of nickel nanoparticles were more influenced by volume ratio of methanol/ethanol than the reactants mixing rate. Super-paramagnetic nickel nanoparticles with size range between 20 and 50 nm were achieved when solvent was pure methanol and the reactants mixing rate was kept at 70 ml/h. But addition of more ethanol to precursor solvent leads to the formation of larger particles with broader size distribution and weak ferromagnetic or super-paramagnetic behavior.