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                             37 gevonden resultaten
nr titel auteur tijdschrift jaar jaarg. afl. pagina('s) type
1 A comparative spin orbit coupling DFT study of opto-electronic properties of Bi 2 Se 3 and Bi 2 Te 3 bulk crystal Ahmed, Burhan
40 C p.
 artikel
2 A comprehensive first-principles investigation of structural, electronic, vibrational, optical, thermodynamic and thermoelectric properties of LiZnAs Panchal, J.M.
40 C p.
 artikel
3 A comprehensive theoretical analysis on structural, electronic, optical, and mechanical properties of Sr2VRuO6 compound Mender, S.
40 C p.
 artikel
4 AI-driven ensemble learning for accurate Seebeck coefficient prediction in half-Heusler compounds based on chemical formulas Ben Kamri, Ahmed Lamine
40 C p.
 artikel
5 Analysis of Na2CuP ternary semiconductor compound for optoelectronic application by first-principles methods using GGA and mGGA functionals Musembi, Robinson
40 C p.
 artikel
6 A theoretical equation of state to formulate the melting curve of metals with varying pressure Patel, Jaya
40 C p.
 artikel
7 Computational investigation of quantum capacitance enhancement in Mg-substituted MgB 2 -based supercapacitor electrodes T., Sruthi
40 C p.
 artikel
8 DFT+U study of TlXBr3 (X = Sn, Ge) perovskites as next-generation materials for optoelectronics applications Rehman, Muhammad Awais
40 C p.
 artikel
9 Dynamical stability, electronic and optical properties of AcAlO3 perovskite using mBJ and hybrid functionals: A DFT approach Ashwin, V.
40 C p.
 artikel
10 Editorial Board
40 C p.
 artikel
11 Effect of V-VIB group ternary elements on the properties of Ti2AlM-type O-phases: A first-principles study Heidari Pebdani, Zeinab
40 C p.
 artikel
12 Elastic-acoustic, optical and thermoelectric investigation of Cu6AsS5X (X= Br, I) for renewable energy applications Ibrar, Muhammad
40 C p.
 artikel
13 Electronic and structural insights into boron nitride counterparts of Net-(Y,W) Lima, K.A.L.
40 C p.
 artikel
14 Empirical band-gap correction for LDA-derived atomic effective pseudopotentials Kumar, Surender
40 C p.
 artikel
15 Energetic, electronic structure and work function of the (0001), (10 1 ‾ 0), and (11 2 ‾ 0) BaAl2O4 surfaces; A first-principles study Lahmer, M.A.
40 C p.
 artikel
16 Explore the fascinating realm of comparing metal melting curves by applying the equation of state and Lindemann's law Srivastava, Abhay P.
40 C p.
 artikel
17 Exploring defect engineering in monolayer TiS 3 for next-generation electronic devices: Insights from first-principles study Dongho-Nguimdo, G.M.
40 C p.
 artikel
18 ″ First-principles calculations of optoelectronic characteristics of Eu 3 + & Tb 3 + doped BaSiO 3 for energy renewable devices applications ″ Imran, Muhammad
40 C p.
 artikel
19 First-principles investigations of structural, electronic and optical properties of ternary chalcopyrite semiconductors CuIn Y 2 ( Y = S , Se and Te ) Mahraj, Issam
40 C p.
 artikel
20 Innovative study and analysis on MAX phase (Ti3AlC2) A-layer atom solid solution with potential A site doped elements Sun, Liang
40 C p.
 artikel
21 Insights into effect of dopant site and dopant concentration on structural, electronic and optical properties of GaNbO 4 and its implications on visible light photocatalytic behavior: An ab-initio study Kshirsagar, Bhakti
40 C p.
 artikel
22 Insight view of thermal, mechanical and structural behavior of novel double perovskites Ba2XSbO6 (X = Sc, Y): A DFT based study Muneersab, Shaikh Sameer
40 C p.
 artikel
23 Investigation of direct small bandgap Cs2AuInX6 (X= F/Cl) double perovskites for energy harvesting technology employing DFT Mahmud, S.
40 C p.
 artikel
24 Investigations of the physical behavior of Cr2PX (X = C and N) MAX phases through first-principles calculations Ul Haq, Bakhtiar
40 C p.
 artikel
25 Magnetic ordering and the role of superexchange Ni–O–B–O–Ni upon the formation of magnetic order in ludwigite Ni2MnBO5 from first-principal calculations Sofronova, Svetlana
40 C p.
 artikel
26 Novel KXBr3 (X = Ca, Sr, Ba) lead-free halide perovskites for optoelectronic applications: A DFT investigation of mechanical and optoelectronic properties Pingak, Redi Kristian
40 C p.
 artikel
27 On the interplay of tetrahedral and octahedral hydrogen absorption sites in the Ti28V20Cr52 alloy: First principles study Muñiz, César Menéndez
40 C p.
 artikel
28 Prediction of magnetic nature of oxide compositions by using machine learning models Siddique, Abu Bakar
40 C p.
 artikel
29 Pressure and atomic size effects of IV cation on mechanical and electronic properties of Zn-IV-N2 (IVSi, Ge and Sn): First principles calculation Boonkhuang, Apiwat
40 C p.
 artikel
30 Structural, electronic, thermoelectric and optical properties of 2D hexagonal beryllium telluride under DFT investigation Makavana, Ashish
40 C p.
 artikel
31 Study of optical responsivity and electronic properties of ternary halide perovskite semiconductors - CaKI3 and CaRbI3 for optoelectronic applications - A DFT approach Kaleemullah, N. Syed
40 C p.
 artikel
32 Study of the physical properties of the Li2CuO2 compound Idrissi, S.
40 C p.
 artikel
33 Study on the possibility of band gap widening of thermoelectric semiconductor α-SrSi2 by isoelectronic elements incorporation Hiraoka, Yuki
40 C p.
 artikel
34 The electronic structures, half-metallic ferromagnetism, optical, and thermoelectric responses of the Co-doped Au2S chalcogenide compound Nakoul, Z.
40 C p.
 artikel
35 Theoretical investigation of structural and mechanical stability, electronic, optical, and transport behaviour of double halide perovskites K2GaBiX6 (X= Cl, Br, and I) for optoelectronic applications Shakil, M.
40 C p.
 artikel
36 Two novel stable phases of polonium oxides from first-principles evolutionary algorithm Menad, A.
40 C p.
 artikel
37 Understanding the mechanical, opto-electronic, and thermoelectric properties of lead-free Silver based perovskites Cs2YAgX6 (X=Cl, Br, I): A computational study Abdullah, Danish
40 C p.
 artikel
                             37 gevonden resultaten
 
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