Yazar "Taşseven, C." için Makale Koleksiyonu listeleme
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First - principles calculations on stability and mechanical properties of various ABO(3) and their alloys
Akgenç, Berna; Kınacı, A.; Taşseven, C.; Çagın, T. (Elsevier Science Sa, 2018)In this study, we perform first principle calculations based on density functional theory (DFT) to obtain the ground state structural, elastic and dielectric properties of various ABO(3) type ceramics and their {A(x)A'((1-x))}BO3 ... -
Modeling Superionic Behavior of Plutonium Dioxide
Günay, Süleyman Gökhan; Akgenç, Berna; Taşseven, C. (Walter De Gruyter Gmbh, 2016)The Bredig transition to the superionic phase indicated with the.-peak in C-p was highly expected for plutonium dioxide (PuO2) as other actinide dioxides. However, least-square fit and local smoothing techniques applied ... -
NPT simulation and hypernetted-chain calculations of SrCl 2
Akgenç, Berna; Akdere, Ü.; Günay, S. D; Taşseven, C. (2013)Transition to fast-ion conducting phase and liquid phase of SrCl2 was investigated the molecular dynamics simulation in constant pressure-temperature ensemble (NPT) and hypernetted-chain theory using the fully ionic rigid ... -
Thermophysical Properties of α-Pu2O3: A New Potential Model
?-Pu2O3 is an important material among plutonium based materials in nuclear industry. Pure plutonium surfaces quickly oxidizes into ?-Pu2O3 and PuO2 which are in the form of layers one on another [1]. Here we have ...