Browsing by Author "Gencer, Ayşenur"
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Anisotropic mechanical properties of Tl4Ag18Te11 compound with low thermal conductivity
Gencer, Ayşenur; Sürücü, Özge; Sürücü, Gökhan; Deligöz, Engin (Academic Press Inc., 2020)The anisotropic mechanical properties of Tl4Ag18Te11 compound was investigated elaborately for the first time by using Density Functional Theory calculations with the Vienna Ab-initio Simulation Package in this work. ... -
Complex nodal structure phonons formed by open and closed nodal lines in CoAsS and Na2CuP solids
Ding, Guangqian; Sun, Tingting; Sürücü, Gökhan; Sürücü, Özge; Gencer, Ayşenur; Wang, Xiaotian (Royal Society of Chemistry, 2022)Topological phononic states with nodal lines not only have updated our knowledge of the phases of matter in a fundamental way, but also have become a major frontier research direction in condensed matter physics. From a ... -
Effect of Hydrogen Doping to MgTiH3 Perovskite Type Hydride to Enhance Hydrogen Storage Properties
Gencer, Ayşenur; Sürücü, Gökhan (Institute of Electrical and Electronics Engineers Inc., 2019)MgTiH3 perovskite type hydride has been investigated for the hydrogen doping effect using the first principles calculation with the Vienna Ab-initio Simulation Package. The hydrogen doping positions have been determined ... -
Equiatomic quaternary CoXCrAl (X = V, Nb, and Ta) Heusler compounds: Insights from DFT calculations
Dağ, Tuğçe Sevinç; Gencer, Ayşenur; Çiftçi, Yasemin; Sürücü, Gökhan (Elsevier, 2022)The half-metallic ferromagnets are likely materials to the spintronics systems for the next generation electronic devices. Among the half-metallic ferromagnetic materials, the equiatomic quaternary Heusler (EQH) compounds ... -
Experimental and theoretical investigation of the mechanical characteristics of sillenite compound: Bi12GeO20
Sürücü, Gökhan; Işık, Mehmet; Gencer, Ayşenur; Gasanly, Nizami (Elsevier Ltd, 2021)The present study reports the mechanical and elastic characteristics of Bi12GeO20 (BGO) compound by experimental nanoindentation measurements and density functional theory (DFT) calculations. X-ray diffraction pattern of ... -
Pressure and spin effect on the stability, electronic and mechanic properties of three equiatomic quaternary Heusler (FeVHfZ, Z = Al, Si, and Ge) compounds
Sürücü, Gökhan; Gencer, Ayşenur; Sürücü, Özge; Usanmaz, Demet; Candan, Abdullah (Elsevier Ltd, 2021)In this paper, three equiatomic quaternary Heusler compounds − FeVHfZ (Z = Al, Si, and Ge) − are investigated for their structural, magnetic, electronic, mechanic, and lattice dynamic properties under pressure effect. These ...
