Theta Point Calculation of a Polymer Chain with Electric Dipole Moments: Monte Carlo Simulation

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dc.contributor.authorUyaver, Şahin
dc.date.accessioned2025-02-20T10:28:47Z
dc.date.available2025-02-20T10:28:47Z
dc.date.issued2020
dc.departmentTürk-Alman Üniversitesien_US
dc.description.abstractMonte Carlo simulations are used to simulate a single polymer chain in a more generalized model. The more generalized model differs from the simpler models by including dipole-dipole interactions. The polymer chain is modeled as a freely rotating chain where the neighboring beads are connected by harmonic spring. Excluded volume effects are included employing modified Lennard-Jones potential. As the extension in this work, each monomer unit carries permanently a freely-rotating electric dipole moment. After getting the system equilibrated the average values are measured and ?-temperature of the system is determined. The effects of the presence of the dipole moments to the ?-temperature of the system are investigated. The results are analyzed in comparison with a bare model.Keywords: Polymer Chain, Theta Temperature, Monte Carlo, Dipole-dipole interaction
dc.identifier.doi10.16984/saufenbilder.710797
dc.identifier.endpage871en_US
dc.identifier.issn1301-4048
dc.identifier.issn2147-835X
dc.identifier.issue5en_US
dc.identifier.startpage865en_US
dc.identifier.trdizinid471355
dc.identifier.urihttps://doi.org/10.16984/saufenbilder.710797
dc.identifier.urihttps://search.trdizin.gov.tr/tr/yayin/detay/471355
dc.identifier.urihttps://hdl.handle.net/20.500.12846/1868
dc.identifier.volume24en_US
dc.indekslendigikaynakTR-Dizin
dc.institutionauthorUyaver, Şahin
dc.language.isoen
dc.relation.ispartofSakarya Üniversitesi Fen Bilimleri Enstitüsü Dergisi
dc.relation.publicationcategoryMakale - Ulusal Hakemli Dergi - Kurum Öğretim Elemanı
dc.rightsinfo:eu-repo/semantics/openAccess
dc.snmzKA_TR-Dizin_20250220
dc.subjectFiziken_US
dc.subjectAtomik ve Moleküler Kimyaen_US
dc.subjectPolimer Bilimien_US
dc.subjectİstatistik ve Olasılıken_US
dc.titleTheta Point Calculation of a Polymer Chain with Electric Dipole Moments: Monte Carlo Simulation
dc.typeArticle

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