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                             27 gevonden resultaten
nr titel auteur tijdschrift jaar jaarg. afl. pagina('s) type
1 A comprehensive study of the magnetic, electronic, mechanical, and thermoelectric properties of novel filled skutterudites KFe4Ge12 and KFe4P12 using ab-initio calculations Nayak, Poorva
38 C p.
 artikel
2 A first-principles investigation on the structural, electronic and optical characteristics of tetragonal compounds XAgO (X = Li, Na, K, Rb) Allali, Djamel
38 C p.
 artikel
3 A reinterpretation of the results for melting curves of metals based on the force – Heat equivalence energy density principle Sunil, K.
38 C p.
 artikel
4 Comparative DFT-based investigation of physical properties of Cs2MBiBr6 (M= Ag, Cu, and Au) Perovskites: Sustainable materials for renewable energy Ayyaz, Ahmad
38 C p.
 artikel
5 Comparative study of magnetic stability, electronic, optical, thermoelectric and thermal properties of Co2FeSn and Fe2CoSn full Heusler alloys from first principles approch Raïâ, M.Y.
38 C p.
 artikel
6 Corrigendum to “The effect of Sn doping on the structural, electronic and magnetic properties of rutile CrO2: A DFT approach” [Comput. Condens. Matter 31 (2022) e00658] Biswas, Sarajit
38 C p.
 artikel
7 Effect of dual Nitrogen doping on the electronic, thermodynamic, transport and thermoelectric properties of graphene Gadhavi, Pratik M.
38 C p.
 artikel
8 Electronic, magnetic, and thermodynamic properties of orthorhombic C e S c O 3 , C e T i O 3 , and C e V O 3 using GGA and GGA+U Maskar, E.
38 C p.
 artikel
9 Electro-optical and thermoelectric properties of perovskite CsKAgBi X 6 ( X = C l , B r , I ) : A DFT study Adegboyega, Anthony B.
38 C p.
 artikel
10 First principal calculations for understanding physical properties and possible applications of vacancy ordered double perovskite Cs2ZrI6 (CZI) Das, Subhendu
38 C p.
 artikel
11 First principle investigation on properties of MnO2 as an electrode material for Li, Na, Mg, and Al -ion batteries Hafizi, Mahziar
38 C p.
 artikel
12 First-principles calculations to examine structural, magnetic, mechanical, electronic and optical properties of wide bandgap semiconductor Gadolinium Aluminum Oxide perovskite GdAlO3 Kourdaci, A.E.
38 C p.
 artikel
13 First principles prediction of geometrical, electronic, mechanical, thermodynamic, optical and photocatalytic properties of RaZrO3 scrutinized by DFT investigation Munshi, Md. Rajib
38 C p.
 artikel
14 First-principles prediction of optoelectronic and thermoelectric properties of novel materials A2PdCl6 for Photovoltaic Applications Behilil, S.N.
38 C p.
 artikel
15 First principles prediction of structural, electronic, mechanical, thermodynamic, optical and photocatalytic properties of In(X)O2, where X= Cu, Ag crystal scrutinized by hybrid DFT Munshi, Md. Rajib
38 C p.
 artikel
16 First-principles study of the electronic, magnetic, and optical properties of Mn-doped cubic perovskite KTaO3 Espinosa-González, D.
38 C p.
 artikel
17 Formulation of an appropriate equation of state to predict the melting temperature of metallic solids Patel, Jaya
38 C p.
 artikel
18 Influence of main-group elements on structural, electronic, magnetic and half-metallic properties of DO3-type Mn3Z (Z = Al, Ga, In, Si, Ge, Sn, P, As and Sb) alloys - A DFT study Chinnadurai, Kanagaraj
38 C p.
 artikel
19 Interatomic distances for alkali halides at high pressure Kanhaiyalal,
38 C p.
 artikel
20 Prediction of feasibility of Li and Fe doped natural olivine Mg2SiO4 for Li ion battery applications using Density Functional Theory Chakrabarti, Shamik
38 C p.
 artikel
21 Predictive analysis of a new FeVTe alloy from first principles: An excellent choice for thermoelectric applications Nenuwe, Nelson O.
38 C p.
 artikel
22 Pressure-induced band gap engineering and enhanced optoelectronic properties of non-toxic Ca-based perovskite CsCaCl3: Insights from density functional theory Jellil, Z
38 C p.
 artikel
23 Structure property correlation study of energetic solid XeO3 Mukherjee, Supratik
38 C p.
 artikel
24 Study of optoelectronics and magnetic properties of GdCrWO6 oxide by ab initio calculations El-harrar, Y.
38 C p.
 artikel
25 Theoretical investigation of structural instabilities of newly predicted superconducting Heusler alloys Rh2NbZ (Z = Al, Ga, Sn): Ab initio approach Datta, Subarna
38 C p.
 artikel
26 Tuning of band gap and enhancing electronic properties of CsSnBr3 under high pressure for optoelectronic applications H.-E., M. Musa Saad
38 C p.
 artikel
27 Unveiling the pressure-driven modulations in AGeF3 (A = Na, Tl) cubic perovskite halides for enhanced optoelectronic performance Rabbi, Shariare Hossain
38 C p.
 artikel
                             27 gevonden resultaten
 
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