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Janus Aluminum Oxysulfide Al2OS: A promising 2D direct semiconductor photocatalyst with strong visible light harvesting
Haman, Z.
;
Khossossi, N.
;
Kibbou, M.
;
Bouziani, I.
;
Singh, D.
;
Essaoudi, I.
;
Ainane, A.
;
Ahuja, R.
(
2022-04-23
)
Distilling physical origins of hardness in multi-principal element alloys directly from ensemble neural network models
Beniwal, D.
;
Singh, P.
;
Gupta, S.
;
Kramer, M.J.
;
Johnson, D.D.
;
Ray, P.K.
(
2022-08-15
)
Investigation of topological phases and thermoelectricity in half Heusler compounds: an Ab initio study
Yadav, A.
(
2022-09-23
)
Existence of yttrium allotrope with incommensurate host–guest structure at moderate pressure: First evidence from computational approach
Tsuppayakorn-aek, P.
;
Bovornratanaraks, T.
;
Ahuja, R.
;
Bovornratanaraks, T.
;
Luo, W.
(
2022-09-22
)
First principles design and investigation of 2-dimensional carbon lattices and their hetero-atom doped analogues for alkali ion batteries
Yadav, N.
(
2022-11-24
)
Activation-induced surface modulation of biowaste-derived hierarchical porous carbon for supercapacitors
Sharma, P.
;
Singh, D.
;
Minakshi, M.
;
Quadsia, S.
;
Ahuja, R.
(
2022-07-17
)
Non-trivial band topology in Bi doped Lanthanum monopnictides (LaX; X = As and Sb)
Wadhwa, P.
;
Dhilip Kumar, T.J.
;
Shukla, A.
;
Kumar, R.
(
2022-12-10
)
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Author
Ahuja, R. (3)
Singh, D. (2)
Ainane, A. (1)
Beniwal, D. (1)
Bouziani, I. (1)
Bovornratanaraks, T. (1)
Dhilip Kumar, T.J. (1)
Essaoudi, I. (1)
Gupta, S. (1)
Haman, Z. (1)
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Subject
Density functional theory (7)
First-principles calculations (2)
2-Dimensional materials (1)
2D Janus Aluminum Oxysulfide (1)
ab initio molecular dynamics (1)
Activated carbon (1)
Adsorption energy (1)
Bi-axial strain (1)
Biowaste (1)
Bronsted-Evans-Polanyi linear relation (1)
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Date Issued
2022 (7)