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First-principles calculations to investigate electronic structure and optical properties of 2D MgCl2 monolayer
Mahida, H.R.
;
Patel, A.
;
Singh, D.
;
Sonvane, Y.
;
Thakor, P.B.
;
Ahuja, R.
(
2022-06-13
)
Structural stability and electronic properties of 2D MXene Hf3C2F2 monolayer by density functional theory approach
Jadav, R.P.
;
Mishra, P.
;
Kumavat, S.
;
Singh, D.
;
Ahuja, R.
;
Sonvane, Y.
(
2022-07-23
)
Theoretical prediction of a Bi-Doped β-Antimonene monolayer as a highly efficient photocatalyst for oxygen reduction and overall water splitting
Singh, D.
;
Ahuja, R.
(
2022-08-16
)
Probing the electronic, optical and transport properties of halide double perovskites Rb2InSb(Cl,Br)6 for solar cells and thermoelectric applications
Kibbou, M.
;
Haman, Z.
;
Khossossi, N.
;
Singh, D.
;
Essaoudi, I.
;
Ainane, A.
;
Ahuja, R.
(
2022-07-17
)
Bifunctional catalytic activity of 2D boron monochalcogenides BX (X = S, Se, Te)
Mishra, P.
;
Singh, D.
;
Sonvane, Y.
;
Ahuja, R.
(
2022-07-17
)
Hydrogen passivated 𝛽12-borophene nanoribbon: A propitious one-dimensional metallic anode for sodium-ion rechargeable batteries
Choudhary, S.
;
Duhan, N.
;
Kumar, T.J.D
(
2022-10-27
)
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Author
Ahuja, R. (5)
Singh, D. (5)
Sonvane, Y. (3)
Mishra, P. (2)
Ainane, A. (1)
Choudhary, S. (1)
Duhan, N. (1)
Essaoudi, I. (1)
Haman, Z. (1)
Jadav, R.P. (1)
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Subject
Electronic properties (6)
First-principles calculations (2)
Optical properties (2)
Structural stability (2)
2D antimonene monolayer (1)
2D monolayer MgCl2 material (1)
Borophene nanoribbon (1)
Charge transfer mechanism (1)
Density-functional theory ab-initio molecular dynamics (1)
Doping effect (1)
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Date Issued
2022 (6)