صورة الغلاف

Pressure dependence of structural, elastic and electronic properties of α-Al2O3: first-principles calculations

The first-principles calculations were performed to investigate the structural, elastic, mechanical and electronic properties of α-Al2O3 at applied pressure up to 50 GPa. The obtained ground state properties were in agreement with previous experimental and theoretical data. The elastic constants, bu...

وصف كامل

محفوظ في:

التفاصيل البيبلوغرافية
المؤلفون الرئيسيون:	Liu, Qi-Jun, Liu, Zheng-Tang
التنسيق:	مقال
اللغة:	English
منشور في:	Penerbit Universiti Kebangsaan Malaysia 2016
الوصول للمادة أونلاين:	http://journalarticle.ukm.my/10301/1/17%20Qi-Jun%20Liu.pdf http://journalarticle.ukm.my/10301/ http://www.ukm.my/jsm/english_journals/vol45num10_2016/contentsVol45num10_2016.html
الوسوم:	إضافة وسم لا توجد وسوم, كن أول من يضع وسما على هذه التسجيلة!

مواد مشابهة

First principle calculation on elastic and electronic properties of cubic PBTIO₃ / Fadhlul Wafi Badrudin
بواسطة: Badrudin, Fadhlul Wafi
منشور في: (2012)

Structural, electronic, elastic, and thermal properties of CaNiH3 perovskite obtained from first-principles calculations
بواسطة: Benlamari, S., وآخرون
منشور في: (2018)

First-principles calculations of structural, elastic, electronic and transport properties of vanadium-doped zirconium lead carbide max phase
بواسطة: Ahams, Summanuwa Timothy
منشور في: (2022)

Elastic, electronic and optical properties of baddeleyite TiO2 by first-principles
بواسطة: Mahmood, Tariq, وآخرون
منشور في: (2014)

First-principles calculations of structural and electronic properties of MgO and Li DOPED MgO / Dzulkhairi Tajuddin Mustaffa
بواسطة: Mustaffa, Dzulkhairi Tajuddin
منشور في: (2019)

First-principles calculations of structural, elastic, electronic, and optical properties of perovskite-type KMgH3 crystals: Novel hydrogen storage material
بواسطة: Ali Hussain, Reshak, Prof. Dr., وآخرون
منشور في: (2011)

First-principles calculations on structural, electronic and optical oroperties of Ce-, Nd- and Er-doped TiO2
بواسطة: M. H., Samat, وآخرون
منشور في: (2021)

Structural, elastic, electronic and optical properties of Cu3TMSe4 (TM = V, Nb and Ta) sulvanite compounds via first-principles calculations
بواسطة: K., Bougherara, وآخرون
منشور في: (2014)

First-principles calculations to investigate structural, electronic, elastic, magnetic, and thermodynamic properties of full-Heusler Rh(2)MnZ (Z = Zr, Hf)
بواسطة: Mentefa, Amal, وآخرون
منشور في: (2021)

Structural, elastic, thermal, electronic and optical properties of Ag₂O under pressure
بواسطة: Haleem Ud Din, وآخرون
منشور في: (2014)

First-Principle Calculations of Structural, Elastic, and Electronic Properties of Intermetallic Rare Earth R2Ni2Pb (R = Ho, Lu, and Sm) Compounds
بواسطة: Benkaddour, Y., وآخرون
منشور في: (2018)

First-principles calculations of structural, electronic, and optical properties for Ni-doped Sb2S3
بواسطة: Radzwan, Afiq, وآخرون
منشور في: (2020)

First principle calculation on the structural, electronic and transport properties of graphene, silicene and germanene substrate system
بواسطة: Hamid, Mohamad Amin
منشور في: (2020)

First principle DFT calculation for structural and electronic properties of magnesium indium sulphide and cadmium indium sulphide
بواسطة: Dalhatu, Saddiq Abubakar
منشور في: (2013)

First-principles calculations of the structural, electronic and optical properties of cubic BxGa1−xAs alloys
بواسطة: Guemou, M., وآخرون
منشور في: (2013)

First-principles study of structural stabilities, elastic and electronic properties of transition metal monocarbides (TMCs) and mononitrides (TMNs)
بواسطة: Rached, Habib, وآخرون
منشور في: (2014)

Structural, electronic, optical and thermodynamic investigations of NaXF 3 (X = Ca and Sr): First-principles calculations
بواسطة: Benkabou, M.H., وآخرون
منشور في: (2018)

Structural, electronic, optical and thermodynamic investigations of NaXF3 (X=Ca and Sr): First-principles calculations
بواسطة: Benkabou, M. H., وآخرون
منشور في: (2018)

First-principle calculations to investigate the elastic and thermodynamic properties of RBRh 3 (R =Sc, y and La) perovskite compounds
بواسطة: Litimein, F., وآخرون
منشور في: (2013)

First-principles calculation on electronic properties of zinc oxide by zinc 13air system
بواسطة: Mohamad, Ahmad Azmin, وآخرون
منشور في: (2017)

Structural, elastic, mechanical and thermodynamic properties of Terbium oxide: First-principles investigations
بواسطة: Al Qaisi, S., وآخرون
منشور في: (2017)

First principles study of the structural, elastic and electronic properties of Ti2InC and Ti2InN
بواسطة: Benayad, N., وآخرون
منشور في: (2011)

First-principles density functional theory based electronic structure calculations of some zinc-oxide and zinc-sulphide polymorphs
بواسطة: Saira, Shabbir
منشور في: (2021)

First-principles computations of YxGa1−x As-ternary alloys: a study on structural, electronic, optical and elastic properties
بواسطة: Touam, S., وآخرون
منشور في: (2020)

First-principles investigation of structural, elastic, electronic and thermodynamic properties of strongly correlated ternary system: The DFT plus U approach
بواسطة: Chiromawa, Idris Muhammad, وآخرون
منشور في: (2021)

Structural, elastic and lattice dynamical properties of the alkali metal tellurides: First-principles study
بواسطة: Souadia, Z., وآخرون
منشور في: (2017)

Multi-node parallelization performance of first-principles calculations
بواسطة: Buba, Mohammed
منشور في: (2019)

First-principles calculations of the structural and electronic properties of AIN, GaN, InN, AIGaN and InGaN
بواسطة: Beloufa, Abbes, وآخرون
منشور في: (2009)

First-principles predictions of the structural, electronic, optical and elastic properties of the zintl-phases AE3GaAs3 (AE = Sr, Ba)
بواسطة: Khireddine, A., وآخرون
منشور في: (2015)

Dominant ferromagnetic coupling over antiferromagnetic in Ni doped ZnO: first-principles calculations
بواسطة: Ul Haq, Bakhtiar, وآخرون
منشور في: (2016)

Electronic and chemical properties of cyanated, halogenated and thiophene-based linear acene derivatives by first-principles calculations
بواسطة: Musa, Auwalu
منشور في: (2016)

Electronic and thermoelectric properties of the layered Zintl phase CaIn2P2: first-principles calculations
بواسطة: Guechi, N., وآخرون
منشور في: (2020)

Temperature dependence of elastic properties of aluminium foam structures
بواسطة: Hosseini, Seyed Mohd. Hossien, وآخرون
منشور في: (2012)

First-principles study on the doping effects of La on the structural, electronic and optical properties of MgO
بواسطة: Mohamad Fariz, Mohamad Taib, وآخرون
منشور في: (2021)

Influence of crystal orientation on the corrosion behaviour of copper, aluminium and niobium studied using first-principles calculation
بواسطة: Yang, Jun
منشور في: (2023)

First-principle calculations of structural, electronic and magnetic investigations of Mn2RuGe1-xSnx quaternary Heusler alloys
بواسطة: Semari, F., وآخرون
منشور في: (2018)

First-principles calculations of antimony sulphide Sb2S3
بواسطة: Radzwan, Afiq, وآخرون
منشور في: (2017)

First principle elastic property study of Î±-AI2O3for application as nano-proppants
بواسطة: Danso, D.K., وآخرون
منشور في: (2022)

First-principles study of structural, electronic, elastic and thermal properties of intermetallic ternary compounds (RMn2Si2: R=Ce and Nd)
بواسطة: Louhab, H., وآخرون
منشور في: (2015)

First-principles calculations to investigate the effect of Van der Waals interactions on the crystal and electronic structures of tin-based 0D hybrid perovskites
بواسطة: Ferjani, Hela, وآخرون
منشور في: (2022)