Hoat DM - Search Results

1

Theoretical prediction of two-dimensional BC₂X (X = N, P, As) monolayers: ab initio investigations.

Bafekry A, Naseri M, Faraji M, Fadlallah MM, Hoat DM, Jappor HR, Ghergherehchi M, Gogova D, Afarideh H. Bafekry A, et al. Among authors: hoat dm. Sci Rep. 2022 Dec 23;12(1):22269. doi: 10.1038/s41598-022-26805-8. Sci Rep. 2022. PMID: 36564522 Free PMC article.

2

First principles investigation on elastic, optoelectronic and thermoelectric properties of KYX (X = Ge, Sn and Pb) half-heusler compounds.

Naseri M, Hoat DM. Naseri M, et al. Among authors: hoat dm. J Mol Graph Model. 2019 Nov;92:249-255. doi: 10.1016/j.jmgm.2019.08.002. Epub 2019 Aug 9. J Mol Graph Model. 2019. PMID: 31422197

3

Theoretical prediction of 2D XI₂ (X=Si, Ge, Sn, Pb) monolayers by density functional theory.

Naseri M, Hoat DM, Salehi K, Amirian S. Naseri M, et al. Among authors: hoat dm. J Mol Graph Model. 2020 Mar;95:107501. doi: 10.1016/j.jmgm.2019.107501. Epub 2019 Nov 19. J Mol Graph Model. 2020. PMID: 31787502

4

First-principles investigation of nonmetal doped single-layer BiOBr as a potential photocatalyst with a low recombination rate.

Obeid MM , Stampfl C , Bafekry A , Guan Z , Jappor HR , Nguyen CV , Naseri M , Hoat DM , Hieu NN , Krauklis AE , Vu TV , Gogova D . Obeid MM , et al. Among authors: hoat dm. Phys Chem Chem Phys. 2020 Jul 21;22(27):15354-15364. doi: 10.1039/d0cp02007a. Epub 2020 Jun 26. Phys Chem Chem Phys. 2020. PMID: 32589177

5

New equiatomic quaternary Heusler compounds without transition metals KCaBX (X = S and Se): Robust half-metallicity and optical properties.

Hoat DM, Hoang DQ, Naseri M, Ponce-Pérez R, Binh NT, Rivas-Silva JF, Cocoletzi GH. Hoat DM, et al. J Mol Graph Model. 2020 Nov;100:107642. doi: 10.1016/j.jmgm.2020.107642. Epub 2020 Jun 20. J Mol Graph Model. 2020. PMID: 32688130

6

Two-dimensional buckled tetragonal cadmium chalcogenides including CdS, CdSe, and CdTe monolayers as photo-catalysts for water splitting.

Naseri M, Bafekry A, Faraji M, Hoat DM, Fadlallah MM, Ghergherehchi M, Sabbaghi N, Gogova D. Naseri M, et al. Among authors: hoat dm. Phys Chem Chem Phys. 2021 Jun 2;23(21):12226-12232. doi: 10.1039/d1cp00317h. Phys Chem Chem Phys. 2021. PMID: 34009225

7

Two-dimensional Janus semiconductor BiTeCl and BiTeBr monolayers: a first-principles study on their tunable electronic properties via an electric field and mechanical strain.

Bafekry A, Karbasizadeh S, Stampfl C, Faraji M, Hoat DM, Sarsari IA, Feghhi SAH, Ghergherehchi M. Bafekry A, et al. Among authors: hoat dm. Phys Chem Chem Phys. 2021 Jul 21;23(28):15216-15223. doi: 10.1039/d1cp01368h. Phys Chem Chem Phys. 2021. PMID: 34235514

8

Effect of adsorption and substitutional B doping at different concentrations on the electronic and magnetic properties of a BeO monolayer: a first-principles study.

Bafekry A, Faraji M, Fadlallah MM, Hoat DM, Khatibani AB, Sarsari IA, Ghergherehchi M. Bafekry A, et al. Among authors: hoat dm. Phys Chem Chem Phys. 2021 Nov 10;23(43):24922-24931. doi: 10.1039/d1cp03196a. Phys Chem Chem Phys. 2021. PMID: 34726216

9

Electronic, optical and thermoelectric properties of a novel two-dimensional SbXY (X = Se, Te; Y = Br, I) family: ab initio perspective.

Bafekry A, Faraji M, Fadlallah MM, Hoat DM, Jappor HR, Sarsari IA, Ghergherehchi M, Feghhi SAH. Bafekry A, et al. Among authors: hoat dm. Phys Chem Chem Phys. 2021 Nov 24;23(45):25866-25876. doi: 10.1039/d1cp03706d. Phys Chem Chem Phys. 2021. PMID: 34766178

10

The mechanical, electronic, optical and thermoelectric properties of two-dimensional honeycomb-like of XSb (X = Si, Ge, Sn) monolayers: a first-principles calculations.

Bafekry A, Shojai F, Hoat DM, Shahrokhi M, Ghergherehchi M, Nguyen C. Bafekry A, et al. Among authors: hoat dm. RSC Adv. 2020 Aug 17;10(51):30398-30405. doi: 10.1039/d0ra05587e. eCollection 2020 Aug 17. RSC Adv. 2020. PMID: 35516017 Free PMC article.

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