Yazar "Çiftçi, Yasemin Öztekin" için listeleme
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Ab initio calculations on the structural and lattice dynamical properties of TmX (X=As, P) compounds
Çoban, Cansu; Çolakoğlu, Kemal; Çiftçi, Yasemin Öztekin (Pergamon-Elsevier Science Ltd, 2012)The structural and lattice dynamical properties of TmX (X=As, P) compounds were investigated using normconserving pseudopotentials within the generalized gradient approximation correction (GGA) of Perdew-Burke-Ernzerhof ... -
Ab initio calculations on the structural, mechanical, electronic, dynamic, and optical properties of semiconductor half-heusler compound zrpdsn
Çiftçi, Yasemin Öztekin; Çoban, Cansu (Walter de Gruyter GMBH, 2016)The structural, mechanical, electronic, dynamic, and optical properties of the ZrPdSn compound crystallising into the MgAgAs structure are investigated by the ab initio calculations based on the density functional theory. ... -
First principles predictions on mechanical and physical properties of HoX (X = As, P)
Çoban, Cansu; Çolakoğlu, Kemal; Çiftçi, Yasemin Öztekin (Elsevier Science Sa, 2011)In this study, the calculated results of the structural, electronic, elastic, lattice dynamic, and thermodynamic properties of HoX (X = As, P) in rocksalt structure (81) are presented. Ab initio calculations were performed ... -
The first principles study on the TmSb compound
Çoban, Cansu; Çolakoğlu, Kemal; Çiftçi, Yasemin Öztekin (Elsevier Science Bv, 2011)The structural, elastic, electronic, thermodynamic, and phonon properties of TmSb which crystallizes in NaCl (B1) phase were analyzed by performing ab-initio calculations based on density functional theory using the Vienna ... -
Pressure effects on structural, electronic and anisotopic elastic properties of Si doped RuGe compound with different concentrations by first-principles calculations
Çiftçi, Yasemin Öztekin; Çoban, Cansu; Evecen, Meryem; Durukan, İlknur Kars (Elsevier Science SA, 2022)In this study, we have performed first-principles density functional theory (DFT) calculations to investigate pressure and composition effects on the structural, elastic, and electronic properties of silicon doped RuGe ternary ... -
The structural, elastic, electronic, thermodynamic and vibrational properties of protactinium monocarbide (pac) from first-principles calculations
Çiftçi, Yasemin Öztekin; Çoban, Cansu; Aydın, Sezgin; Tatar, Aynur; Evecen, Meryem (Amer Scientific Publishers, 2016)The structural, elastic, electronic, thermodynamic, and vibrational properties of protactinium monocarbide (PaC), which crystallizes in NaCl-type phase (B1), were studied by performing ab-initio calculations based on density ... -
Structural, electronic, elastic, optical, and vibrational properties of HfXSb (X = Co, Rh, Ru) half-Heusler compounds: an ab initio study
Çoban, Cansu; Çiftçi, Yasemin Öztekin; Çolakoǧlu, Kemal (Indian Assoc Cultivation Science, 2016)Structural, electronic, elastic, optical, and vibrational properties of ternary half-Heusler compounds HfXSb (X = Co, Rh, Ru) were studied with means of ab initio calculations based on the density functional theory. The ...
